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Q13639 | 5HT4R_HUMAN | 5-hydroxytryptamine receptor 4 (HTR4)

3D structures mapped by conservation among orthologs



[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

IC50 table Ki table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL3901228 OBDepict CH 3 O NH 2 N H O Cl N H N H IC50 = 0.002 nM 426.95 COc1cc(N)c(Cl)cc1C(=O)NCC1CCNC(Cc2c[nH]c3ccccc23)C1 Homo sapiens CHEMBL3887753 cell-based format
CHEMBL3922150 OBDepict H 3 C O H 2 N N H O Cl N N IC50 = 0.005 nM 483.06 COc1cc(N)c(Cl)cc1C(=O)NCC1CCN(CCCCCn2ccc3ccccc32)CC1 Homo sapiens CHEMBL3887753 cell-based format
CHEMBL3967117 OBDepict CH 3 O NH 2 N H O Cl N N IC50 = 0.039 nM 455.0 COc1cc(N)c(Cl)cc1C(=O)NCC1CCN(CCCn2ccc3ccccc32)CC1 Homo sapiens CHEMBL3887753 cell-based format
CHEMBL2181170 OBDepict CH 3 N O N N F Ki = 0.04 nM 353.44 CCCN1CCC(COc2nc3c(F)cccc3c3ncccc23)CC1 Homo sapiens CHEMBL2188200 single protein format
CHEMBL3950712 OBDepict CH 3 O NH 2 HN O Cl N N N N IC50 = 0.067 nM 406.92 COc1cc(N)c(Cl)cc1C(=O)NCC1CCN(CCCn2ccnn2)CC1 Homo sapiens CHEMBL3887753 cell-based format
CHEMBL3934371 OBDepict CH 3 O NH 2 N H O Cl N N H 3 C IC50 = 0.076 nM 440.98 COc1cc(N)c(Cl)cc1C(=O)NCC1CCN(Cc2cn(C)c3ccccc23)CC1 Homo sapiens CHEMBL3887753 cell-based format
CHEMBL33884 OBDepict O O N CH 3 N N H S O O CH 3 Ki = 0.1 nM 393.51 Cn1cc(C(=O)OCC2CCN(CCNS(C)(=O)=O)CC2)c2ccccc21 Homo sapiens CHEMBL620706 cell-based format
CHEMBL3926377 OBDepict CH 3 O NH 2 N H O Cl N N N N IC50 = 0.103 nM 434.97 COc1cc(N)c(Cl)cc1C(=O)NCC1CCN(CCCCCn2ccnn2)CC1 Homo sapiens CHEMBL3887753 cell-based format
CHEMBL3093186 OBDepict F N O N N F F F Ki = 0.11 nM 407.41 Fc1cccc2c1nc(OCC1CCN(CCC(F)(F)F)CC1)c1cccnc12 Homo sapiens CHEMBL3095861 single protein format
CHEMBL3890747 OBDepict CH 3 O NH 2 N H O Cl N F IC50 = 0.134 nM 405.9 COc1cc(N)c(Cl)cc1C(=O)NCC1CCN(Cc2ccc(F)cc2)CC1 Homo sapiens CHEMBL3887753 cell-based format
CHEMBL3986866 OBDepict CH 3 O NH 2 HN O Cl N N N N N IC50 = 0.164 nM 407.91 COc1cc(N)c(Cl)cc1C(=O)NCC1CCN(CCCn2cnnn2)CC1 Homo sapiens CHEMBL3887753 cell-based format
CHEMBL3957180 OBDepict CH 3 O NH 2 HN O Cl N N N N IC50 = 0.182 nM 406.92 COc1cc(N)c(Cl)cc1C(=O)NCC1CCN(CCCn2nccn2)CC1 Homo sapiens CHEMBL3887753 cell-based format
CHEMBL3093187 OBDepict F N O N N F F F Ki = 0.2 nM 421.44 Fc1cccc2c1nc(OCC1CCN(CCCC(F)(F)F)CC1)c1cccnc12 Homo sapiens CHEMBL3095861 single protein format
CHEMBL3946162 OBDepict CH 3 O NH 2 HN O Cl N N N N IC50 = 0.226 nM 406.92 COc1cc(N)c(Cl)cc1C(=O)NCC1CCN(CCCn2cncn2)CC1 Homo sapiens CHEMBL3887753 cell-based format
CHEMBL3928124 OBDepict CH 3 O NH 2 HN O Cl N N H 3 C N IC50 = 0.229 nM 419.96 COc1cc(N)c(Cl)cc1C(=O)NCC1CCN(CCCn2ccnc2C)CC1 Homo sapiens CHEMBL3887753 cell-based format
CHEMBL2181166 OBDepict I N O N N F Ki = 0.23 nM 555.44 Fc1cccc2c1nc(OCC1CCN(CCCc3ccc(I)cc3)CC1)c1cccnc12 Homo sapiens CHEMBL2188200 single protein format
CHEMBL2181168 OBDepict CH 3 N O N N I Ki = 0.26 nM 461.35 CCCN1CCC(COc2nc3c(I)cccc3c3ncccc23)CC1 Homo sapiens CHEMBL2188200 single protein format
CHEMBL3982522 OBDepict CH 3 O NH 2 N H O Cl N N IC50 = 0.267 nM 388.9 COc1cc(N)c(Cl)cc1C(=O)NCC1CCN(Cc2cccnc2)CC1 Homo sapiens CHEMBL3887753 cell-based format
CHEMBL2179584 OBDepict H 3 C N O N O O Ki = 0.27 nM 358.48 CCCCN1CCC(COc2noc3cccc(OC4CCC4)c23)CC1 Homo sapiens CHEMBL2185685 cell-based format
CHEMBL2179587 OBDepict CH 3 N O N O O CH 3 H 3 C Ki = 0.29 nM 360.5 CCCCN1CCC(COc2noc3cccc(OCC(C)C)c23)CC1 Homo sapiens CHEMBL2185685 cell-based format
CHEMBL2179589 OBDepict CH 3 CH 3 O O N O N OH O Ki = 0.36 nM 418.53 CC(C)COc1cccc2onc(OCC3CCN(CC4(O)CCOCC4)CC3)c12 Homo sapiens CHEMBL2185685 cell-based format
CHEMBL1729 OBDepict CH 3 O N NH O O O Cl H 3 C H 2 N F IC50 = 0.362 nM 465.95 COc1cc(N)c(Cl)cc1C(=O)NC1CCN(CCCOc2ccc(F)cc2)CC1OC Homo sapiens CHEMBL3887753 cell-based format
CHEMBL3920018 OBDepict CH 3 O NH 2 N H O Cl N HO IC50 = 0.375 nM 403.91 COc1cc(N)c(Cl)cc1C(=O)NCC1CCN(Cc2ccc(O)cc2)CC1 Homo sapiens CHEMBL3887753 cell-based format
CHEMBL3915236 OBDepict CH 3 O NH 2 NH O Cl N N H 3 C IC50 = 0.421 nM 390.92 COc1cc(N)c(Cl)cc1C(=O)NCC1CCN(Cc2cccn2C)CC1 Homo sapiens CHEMBL3887753 cell-based format
CHEMBL3910849 OBDepict CH 3 O NH 2 NH O Cl N N N H IC50 = 0.454 nM 377.88 COc1cc(N)c(Cl)cc1C(=O)NCC1CCN(Cc2ncc[nH]2)CC1 Homo sapiens CHEMBL3887753 cell-based format
CHEMBL2152922 OBDepict OH N O O N O O H O Ki = 0.46 nM 432.52 OC1(CN2CCC(COc3noc4cccc(O[C@@H]5CCOC5)c34)CC2)CCOCC1 Homo sapiens CHEMBL2185669 cell-based format
CHEMBL2179580 OBDepict OH N O O N O O H H HO Ki = 0.5 nM 446.54 O[C@@H]1CC[C@@H](Oc2cccc3onc(OCC4CCN(CC5(O)CCOCC5)CC4)c23)C1 Homo sapiens CHEMBL2185685 cell-based format
CHEMBL2179585 OBDepict CH 3 N O N O O Ki = 0.74 nM 372.51 CCCCN1CCC(COc2noc3cccc(OC4CCCC4)c23)CC1 Homo sapiens CHEMBL2185685 cell-based format
CHEMBL2179586 OBDepict H 3 C N O N O O Ki = 0.97 nM 372.51 CCCCN1CCC(COc2noc3cccc(OCC4CCC4)c23)CC1 Homo sapiens CHEMBL2185685 cell-based format
CHEMBL121913 OBDepict CH 3 O NH 2 O O Cl N N N N Ki = 1.0 nM 391.86 COc1cc(N)c(Cl)cc1C(=O)OCCN1CCN(c2ncccn2)CC1 Homo sapiens CHEMBL620706 cell-based format
CHEMBL2181169 OBDepict CH 3 N O N I Ki = 1.2 nM 460.36 CCCN1CCC(COc2nc3c(I)cccc3c3ccccc23)CC1 Homo sapiens CHEMBL2188200 single protein format
CHEMBL121776 OBDepict CH 3 O NH 2 O O Cl N N N N Ki = 1.4 nM 391.86 COc1cc(N)c(Cl)cc1C(=O)OCCN1CCN(c2cnccn2)CC1 Homo sapiens CHEMBL620706 cell-based format
CHEMBL1257991 OBDepict H 3 C N O O O O NH 2 Ki = 1.4 nM 348.44 CCCCN1CCC(COC(=O)c2ccc(N)c3c2OCCO3)CC1 Homo sapiens CHEMBL1259740 cell-based format
CHEMBL3220223 OBDepict CH 3 O NH 2 O O Cl N N N N IC50 = 1.4 nM 467.96 COc1cc(N)c(Cl)cc1C(=O)OCCN1CCN(c2ccccc2-c2cnccn2)CC1 Homo sapiens CHEMBL3222890 single protein format
CHEMBL331396 OBDepict CH 3 O NH 2 O O Cl N N N N Ki = 1.4 nM 391.86 COc1cc(N)c(Cl)cc1C(=O)OCCN1CCN(c2cccnn2)CC1 Homo sapiens CHEMBL620706 cell-based format
CHEMBL332553 OBDepict CH 3 O NH 2 O O Cl N N N Ki = 1.5 nM 390.87 COc1cc(N)c(Cl)cc1C(=O)OCCN1CCN(c2ccccn2)CC1 Homo sapiens CHEMBL620706 cell-based format
CHEMBL1258223 OBDepict CH 3 N O O O Cl O N H H 3 C Ki = 2.0 nM 396.92 CCCCN1CCC(COC(=O)c2cc(Cl)c(NC)c3c2OCCO3)CC1 Homo sapiens CHEMBL1259740 cell-based format
CHEMBL488325 OBDepict H 3 C O H 2 N O O Cl N N H O N H S O O CH 3 Ki = 2.0 nM 581.14 COc1cc(N)c(Cl)cc1C(=O)OCCN1CCC(CNC(=O)CCCNS(=O)(=O)c2ccc(C)cc2)CC1 Homo sapiens CHEMBL962554 cell-based format
CHEMBL330848 OBDepict CH 3 O NH 2 O O Cl N N N N Cl Ki = 2.0 nM 426.3 COc1cc(N)c(Cl)cc1C(=O)OCCN1CCN(c2ccc(Cl)nn2)CC1 Homo sapiens CHEMBL620706 cell-based format
CHEMBL1258671 OBDepict CH 3 N O O O F O H 2 N Ki = 2.1 nM 366.43 CCCCN1CCC(COC(=O)c2cc(F)c(N)c3c2OCCO3)CC1 Homo sapiens CHEMBL1259740 cell-based format
CHEMBL114112 OBDepict CH 3 N O O O I O H 2 N Ki = 2.2 nM 474.34 CCCCN1CCC(COC(=O)c2cc(I)c(N)c3c2OCCO3)CC1 Homo sapiens CHEMBL1259740 cell-based format
CHEMBL1258452 OBDepict CH 3 N O O O H 2 N H 3 C Ki = 2.4 nM 320.43 CCCCN1CCC(COC(=O)c2ccc(N)c(OC)c2)CC1 Homo sapiens CHEMBL1259740 cell-based format
CHEMBL334325 OBDepict H 3 C O N N O O O Cl CH 3 NH 2 IC50 = 3.0 nM 419.91 COc1cccc(N2CCN(CCOC(=O)c3cc(Cl)c(N)cc3OC)CC2)c1 Homo sapiens CHEMBL3222890 single protein format
CHEMBL334325 OBDepict H 3 C O N N O O O Cl CH 3 NH 2 Ki = 3.0 nM 419.91 COc1cccc(N2CCN(CCOC(=O)c3cc(Cl)c(N)cc3OC)CC2)c1 Homo sapiens CHEMBL620706 cell-based format
CHEMBL2181189 OBDepict CH 3 N O N F Ki = 3.1 nM 352.45 CCCN1CCC(COc2nc3c(F)cccc3c3ccccc23)CC1 Homo sapiens CHEMBL2188202 cell-based format
CHEMBL122914 OBDepict CH 3 O NH 2 O O Cl N N N Ki = 3.5 nM 390.87 COc1cc(N)c(Cl)cc1C(=O)OCCN1CCN(c2ccncc2)CC1 Homo sapiens CHEMBL620706 cell-based format
CHEMBL2179590 OBDepict CH 3 OH H 3 C O O N O N OH O Ki = 3.6 nM 434.53 CC(C)(O)COc1cccc2onc(OCC3CCN(CC4(O)CCOCC4)CC3)c12 Homo sapiens CHEMBL2185685 cell-based format
CHEMBL2179581 OBDepict HO N O O N O O O Ki = 4.5 nM 446.54 OC1(CN2CCC(COc3noc4cccc(OC5CCOCC5)c34)CC2)CCOCC1 Homo sapiens CHEMBL2185685 cell-based format
CHEMBL1258338 OBDepict CH 3 N O O O Br O N H H 3 C Ki = 4.5 nM 441.37 CCCCN1CCC(COC(=O)c2cc(Br)c(NC)c3c2OCCO3)CC1 Homo sapiens CHEMBL1259740 cell-based format
CHEMBL2181188 OBDepict CH 3 N O N Cl Ki = 5.0 nM 368.91 CCCN1CCC(COc2nc3c(Cl)cccc3c3ccccc23)CC1 Homo sapiens CHEMBL2188202 cell-based format
CHEMBL490852 OBDepict CH 3 O NH 2 O O Cl N N H O Cl Ki = 5.0 nM 480.39 COc1cc(N)c(Cl)cc1C(=O)OCCN1CCC(NC(=O)Cc2ccccc2Cl)CC1 Homo sapiens CHEMBL962554 cell-based format
CHEMBL2179588 OBDepict CH 3 N O N O O CH 3 H 3 C CH 3 Ki = 5.2 nM 374.53 CCCCN1CCC(COc2noc3cccc(OCC(C)(C)C)c23)CC1 Homo sapiens CHEMBL2185685 cell-based format
CHEMBL2179583 OBDepict F N N N H O O CH 3 H 3 C N OH O Ki = 5.5 nM 448.54 CC(C)n1c(=O)n(C(=O)NCC2CCN(CC3(O)CCOCC3)CC2)c2cc(F)ccc21 Homo sapiens CHEMBL2185669 cell-based format
CHEMBL286136 OBDepict CH 3 O NH 2 O O Cl N Ki = 5.6 nM 312.8 COc1cc(N)c(Cl)cc1C(=O)OCCN1CCCCC1 Homo sapiens CHEMBL620706 cell-based format
CHEMBL4526049 OBDepict CH 3 O NH 2 O Cl N HO HO Ki = 5.9 nM 418.92 COc1cc(N)c(Cl)cc1C(=O)CCC1CCN(Cc2ccc(O)c(O)c2)CC1 Homo sapiens CHEMBL4362793 assay format
CHEMBL1258222 OBDepict CH 3 N O O O H 3 C O H 2 N Ki = 6.3 nM 362.47 CCCCN1CCC(COC(=O)c2cc(C)c(N)c3c2OCCO3)CC1 Homo sapiens CHEMBL1259740 cell-based format
CHEMBL2179582 OBDepict O N N H O H 3 C CH 3 F N HO O Ki = 6.8 nM 433.52 CC1(C)C(=O)N(C(=O)NCC2CCN(CC3(O)CCOCC3)CC2)c2cc(F)ccc21 Homo sapiens CHEMBL2185669 cell-based format
CHEMBL328918 OBDepict H 3 C O NH 2 O O Cl N N H S O O N H 3 C CH 3 Ki = 7.0 nM 575.13 COc1cc(N)c(Cl)cc1C(=O)OCCN1CCC(CNS(=O)(=O)c2cccc3c(N(C)C)cccc23)CC1 Homo sapiens CHEMBL620705 cell-based format
CHEMBL1258339 OBDepict CH 3 N O O O I O N H H 3 C Ki = 7.4 nM 488.37 CCCCN1CCC(COC(=O)c2cc(I)c(NC)c3c2OCCO3)CC1 Homo sapiens CHEMBL1259740 cell-based format
CHEMBL4526049 OBDepict CH 3 O NH 2 O Cl N HO HO IC50 = 7.5 nM 418.92 COc1cc(N)c(Cl)cc1C(=O)CCC1CCN(Cc2ccc(O)c(O)c2)CC1 Homo sapiens CHEMBL4362792 assay format
CHEMBL89225 OBDepict H 3 C O NH 2 O O Cl N N H N O N + N O _ O Ki = 7.5 nM 504.93 COc1cc(N)c(Cl)cc1C(=O)OCCN1CCC(CNc2ccc([N+](=O)[O-])c3nonc23)CC1 Homo sapiens CHEMBL620705 cell-based format
CHEMBL2181171 OBDepict CH 3 N O N N Ki = 7.5 nM 335.45 CCCN1CCC(COc2nc3ccccc3c3ncccc23)CC1 Homo sapiens CHEMBL2188202 cell-based format
CHEMBL1255606 OBDepict CH 3 N O O O + N O O _ O H 2 N Ki = 7.8 nM 393.44 CCCCN1CCC(COC(=O)c2cc([N+](=O)[O-])c(N)c3c2OCCO3)CC1 Homo sapiens CHEMBL1259740 cell-based format
CHEMBL1258109 OBDepict CH 3 N O O O O N H H 3 C Ki = 9.1 nM 362.47 CCCCN1CCC(COC(=O)c2ccc(NC)c3c2OCCO3)CC1 Homo sapiens CHEMBL1259740 cell-based format
CHEMBL125926 OBDepict CH 3 O NH 2 O O Cl N N N N Ki = 9.2 nM 391.86 COc1cc(N)c(Cl)cc1C(=O)OCCN1CCN(c2cncnc2)CC1 Homo sapiens CHEMBL620706 cell-based format
CHEMBL85251 OBDepict CH 3 N O O Cl CH 3 H 2 N Ki = 9.33 nM 352.91 CCCCN1CCC(CCC(=O)c2cc(Cl)c(N)cc2OC)CC1 Homo sapiens CHEMBL4329314 assay format
CHEMBL125716 OBDepict CH 3 O NH 2 O O Cl N N N N Cl Ki = 9.8 nM 426.3 COc1cc(N)c(Cl)cc1C(=O)OCCN1CCN(c2cnc(Cl)nc2)CC1 Homo sapiens CHEMBL620706 cell-based format
CHEMBL4451349 OBDepict CH 3 N HN O N N Cl IC50 < 10.0 nM 348.88 CCCCN1CCC(CNC(=O)c2cc(Cl)cn3ccnc23)CC1 Homo sapiens CHEMBL4415156 single protein format
CHEMBL3417009 OBDepict CH 3 O NH 2 O Cl N Ki = 10.4 nM 392.97 COc1cc(N)c(Cl)cc1C(=O)CCC1CCN(CC2CCCCC2)CC1 Homo sapiens CHEMBL4329311 single protein format
CHEMBL1258786 OBDepict CH 3 N O O O H 2 N F Ki = 11.0 nM 352.45 CCCCN1CCC(COC(=O)c2ccc(N)c(OCCF)c2)CC1 Homo sapiens CHEMBL1259740 cell-based format
CHEMBL2112621 OBDepict CH 3 O H 2 N O O Cl N N Ki = 11.5 nM 403.91 COc1cc(N)c(Cl)cc1C(=O)OCCCN1CCN(c2ccccc2)CC1 Homo sapiens CHEMBL620706 cell-based format
CHEMBL490050 OBDepict CH 3 O NH 2 O O Cl N N H O N H Ki = 12.0 nM 531.1 COc1cc(N)c(Cl)cc1C(=O)OCCN1CCC(NC(=O)CCCNCCCc2ccccc2)CC1 Homo sapiens CHEMBL962554 cell-based format
CHEMBL1258561 OBDepict CH 3 N O O O H 2 N H 3 C Ki = 12.0 nM 334.46 CCCCCN1CCC(COC(=O)c2ccc(N)c(OC)c2)CC1 Homo sapiens CHEMBL1259740 cell-based format
CHEMBL4580044 OBDepict CH 3 O NH 2 O Cl N OH O CH 3 Ki = 12.7 nM 432.95 COc1ccc(CN2CCC(CCC(=O)c3cc(Cl)c(N)cc3OC)CC2)cc1O Homo sapiens CHEMBL4362793 assay format
CHEMBL62023 OBDepict CH 3 N O N N H O N H 3 C Ki = 13.0 nM 328.42 CCn1c(=O)n(C(=O)NC2CC3CCC(C2)N3C)c2ccccc21 Homo sapiens CHEMBL1029728 single protein format
CHEMBL197965 OBDepict NH 2 N H O N O O O Cl CH 3 NH 2 Ki = 13.0 nM 511.11 COc1cc(N)c(Cl)cc1C(=O)OCCN1CCC(NC(=O)CCCCCCCCCCN)CC1 Homo sapiens CHEMBL882452 single protein format
CHEMBL123377 OBDepict CH 3 O NH 2 O O Cl N N Ki = 14.3 nM 389.88 COc1cc(N)c(Cl)cc1C(=O)OCCN1CCN(c2ccccc2)CC1 Homo sapiens CHEMBL620706 cell-based format
CHEMBL4580044 OBDepict CH 3 O NH 2 O Cl N OH O CH 3 IC50 = 14.5 nM 432.95 COc1ccc(CN2CCC(CCC(=O)c3cc(Cl)c(N)cc3OC)CC2)cc1O Homo sapiens CHEMBL4362792 assay format
CHEMBL421256 OBDepict H 3 C O NH 2 O O Cl N N F Ki = 16.8 nM 407.87 COc1cc(N)c(Cl)cc1C(=O)OCCN1CCN(c2ccccc2F)CC1 Homo sapiens CHEMBL620706 cell-based format
CHEMBL421256 OBDepict H 3 C O NH 2 O O Cl N N F IC50 = 17.0 nM 407.87 COc1cc(N)c(Cl)cc1C(=O)OCCN1CCN(c2ccccc2F)CC1 Homo sapiens CHEMBL3222890 single protein format
CHEMBL2181187 OBDepict CH 3 N O N O CH 3 Ki = 17.0 nM 364.49 CCCN1CCC(COc2nc3c(OC)cccc3c3ccccc23)CC1 Homo sapiens CHEMBL2188202 cell-based format
CHEMBL1258560 OBDepict CH 3 N O O O H 2 N H 3 C Ki = 17.0 nM 306.41 CCCN1CCC(COC(=O)c2ccc(N)c(OC)c2)CC1 Homo sapiens CHEMBL1259740 cell-based format
CHEMBL1258672 OBDepict CH 3 N O O O H 2 N F Ki = 17.0 nM 338.42 CCCCN1CCC(COC(=O)c2ccc(N)c(OCF)c2)CC1 Homo sapiens CHEMBL1259740 cell-based format
CHEMBL339936 OBDepict CH 3 O NH 2 O O Cl N N O CH 3 Ki = 17.7 nM 419.91 COc1ccc(N2CCN(CCOC(=O)c3cc(Cl)c(N)cc3OC)CC2)cc1 Homo sapiens CHEMBL620706 cell-based format
CHEMBL339936 OBDepict CH 3 O NH 2 O O Cl N N O CH 3 IC50 = 18.0 nM 419.91 COc1ccc(N2CCN(CCOC(=O)c3cc(Cl)c(N)cc3OC)CC2)cc1 Homo sapiens CHEMBL3222890 single protein format
CHEMBL1748 OBDepict CH 3 O N H HN O O Cl CH 3 NH 2 IC50 = 19.0 nM 313.79 COc1cc(N)c(Cl)cc1C(=O)NC1CCNCC1OC Homo sapiens CHEMBL1048158 single protein format
CHEMBL122818 OBDepict CH 3 O N O N O O O Cl CH 3 NH 2 Ki = 23.0 nM 385.85 CCOC(=O)N1CCN(CCOC(=O)c2cc(Cl)c(N)cc2OC)CC1 Homo sapiens CHEMBL620706 cell-based format
CHEMBL333028 OBDepict CH 3 O NH 2 O O Cl N N F Ki = 23.1 nM 407.87 COc1cc(N)c(Cl)cc1C(=O)OCCN1CCN(c2ccc(F)cc2)CC1 Homo sapiens CHEMBL620706 cell-based format
CHEMBL4562793 OBDepict O N H N Ki = 25.0 nM 338.5 O=C(CCC1CCN(CC2CCCC2)CC1)c1ccc2[nH]ccc2c1 Homo sapiens CHEMBL4329314 assay format
CHEMBL1729 OBDepict CH 3 O N NH O O O Cl H 3 C H 2 N F Ki = 29.0 nM 465.95 COc1cc(N)c(Cl)cc1C(=O)NC1CCN(CCCOc2ccc(F)cc2)CC1OC Homo sapiens CHEMBL620696 single protein format
CHEMBL76370 OBDepict CH 3 NH N H NH N N H O H 3 C Ki = 31.0 nM 301.39 CCCCCNC(=N)N/N=C/c1c[nH]c2ccc(OC)cc12 Homo sapiens CHEMBL979354 cell-based format
CHEMBL1258108 OBDepict CH 3 N O O O O N H 2 N Ki = 33.0 nM 373.45 CCCCN1CCC(COC(=O)c2cc(C#N)c(N)c3c2OCCO3)CC1 Homo sapiens CHEMBL1259740 cell-based format
CHEMBL2181185 OBDepict CH 3 N O N F Ki = 33.0 nM 352.45 CCCN1CCC(COc2nc3cc(F)ccc3c3ccccc23)CC1 Homo sapiens CHEMBL2188202 cell-based format
CHEMBL3291085 OBDepict H 3 C N CH 3 O S NH O _ O N + K Ki = 36.0 nM 415.6 CC(C)n1c(=O)c(C(=O)NCCCN2CCCCC2)c([O-])c2ccsc21.[K+] Homo sapiens CHEMBL3296579 single protein format
CHEMBL1258450 OBDepict CH 3 N O O O O N N H H 3 C Ki = 37.0 nM 387.48 CCCCN1CCC(COC(=O)c2cc(C#N)c(NC)c3c2OCCO3)CC1 Homo sapiens CHEMBL1259740 cell-based format
CHEMBL4529710 OBDepict O N H N Ki = 37.5 nM 352.52 O=C(CCC1CCN(CC2CCCCC2)CC1)c1ccc2[nH]ccc2c1 Homo sapiens CHEMBL4329314 assay format
CHEMBL4444843 OBDepict O Cl N H N Ki = 37.5 nM 386.97 O=C(CCC1CCN(CC2CCCCC2)CC1)c1cc(Cl)c2[nH]ccc2c1 Homo sapiens CHEMBL4329314 assay format
CHEMBL4537101 OBDepict H 3 C O O N Cl H N Ki = 40.9 nM 416.99 COc1c(C(=O)CCC2CCN(CC3CCCCC3)CC2)cc(Cl)c2[nH]ccc12 Homo sapiens CHEMBL4329314 assay format
CHEMBL3291084 OBDepict CH 3 O NH 2 O O Cl N ClH IC50 = 49.0 nM 363.29 COc1cc(N)c(Cl)cc1C(=O)OCCCN1CCCCC1.Cl Homo sapiens CHEMBL3296581 cell-based format
CHEMBL4567394 OBDepict CH 3 N O N H Ki = 49.6 nM 312.46 CCCCN1CCC(CCC(=O)c2ccc3[nH]ccc3c2)CC1 Homo sapiens CHEMBL4329314 assay format