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O75116 | ROCK2_HUMAN | Rho-associated protein kinase 2 (ROCK2)

3D structures mapped by conservation among orthologs

[ Domain: "Protein kinase" // Pkinase_Tyr ]

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[ 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
CHEMBL4859660 OBDepict NH 2 N F + N O NH O _ O IC50 = -55800.0 nM 378.36 Nc1ncc(-c2cccc([N+](=O)[O-])c2F)cc1-c1ccc2c(c1)CCNC2=O Homo sapiens CHEMBL4804485 cell-based format
CHEMBL4855542 OBDepict NH 2 N S N O NH IC50 = -11400.0 nM 372.45 Nc1ncc(-c2cccc3ncsc23)cc1-c1ccc2c(c1)CCNC2=O Homo sapiens CHEMBL4804485 cell-based format
CHEMBL3666729 OBDepict H 3 C O O N N N H N N H IC50 = 0.000129 nM 423.48 CCCC(=O)Oc1cccc(-c2nc(Nc3ccc4[nH]ncc4c3)c3ccccc3n2)c1 Homo sapiens CHEMBL3705523 single protein format
CHEMBL3666723 OBDepict CH 3 NH O N N HN O N N H N O IC50 = 0.000151 nM 549.64 CCCC(=O)Nc1cccc(-c2nc(Nc3ccc4[nH]ncc4c3)c3cc(OCCN4CCCC4=O)ccc3n2)c1 Homo sapiens CHEMBL3705523 single protein format
CHEMBL3666755 OBDepict CH 3 NH O N N N H O N N H IC50 = 0.000255 nM 492.58 CCCC(=O)Nc1cccc(-c2nc(Nc3ccc4[nH]ncc4c3)c3cc(OCC4CC4)ccc3n2)c1 Homo sapiens CHEMBL3705523 single protein format
CHEMBL3666742 OBDepict CH 3 O N H O N N N H N N H IC50 = 0.0017 nM 424.46 COCC(=O)Nc1ccccc1-c1nc(Nc2ccc3[nH]ncc3c2)c2ccccc2n1 Homo sapiens CHEMBL3705523 single protein format
CHEMBL3666746 OBDepict OH N N N H N N H IC50 = 0.0025 nM 353.39 Oc1ccccc1-c1nc(Nc2ccc3[nH]ncc3c2)c2ccccc2n1 Homo sapiens CHEMBL3705523 single protein format
CHEMBL3639656 OBDepict H 3 C O N H O N N N H N N H IC50 = 0.0029 nM 410.44 COC(=O)Nc1ccccc1-c1nc(Nc2ccc3[nH]ncc3c2)c2ccccc2n1 Homo sapiens CHEMBL3705523 single protein format
CHEMBL3666761 OBDepict OH N N H N N N H IC50 = 0.0039 nM 353.39 Oc1ccc2nc(-c3ccccc3)nc(Nc3ccc4[nH]ncc4c3)c2c1 Homo sapiens CHEMBL3705523 single protein format
CHEMBL3666754 OBDepict H 3 C HN O N N N H O N N CH 3 N H 3 C CH 3 IC50 = 0.004 nM 523.64 CCCC(=O)Nc1cccc(-c2nc(Nc3ccc4c(cnn4C)c3)c3cc(OCCN(C)C)ccc3n2)c1 Homo sapiens CHEMBL3705523 single protein format
CHEMBL3666741 OBDepict H 3 C N CH 3 N H O N N N H N N H IC50 = 0.0053 nM 451.53 CN(C)CCC(=O)Nc1ccccc1-c1nc(Nc2ccc3[nH]ncc3c2)c2ccccc2n1 Homo sapiens CHEMBL3705523 single protein format
CHEMBL3666760 OBDepict H N N N H N N O N O IC50 = 0.0073 nM 466.55 c1ccc(-c2nc(Nc3ccc4[nH]ncc4c3)c3cc(OCCN4CCOCC4)ccc3n2)cc1 Homo sapiens CHEMBL3705523 single protein format
CHEMBL3666740 OBDepict O N H N N N N H N N H IC50 = 0.0083 nM 457.5 O=C(Nc1ccccc1-c1nc(Nc2ccc3[nH]ncc3c2)c2ccccc2n1)c1ccccn1 Homo sapiens CHEMBL3705523 single protein format
CHEMBL1968705 OBDepict CH 3 NH O N N HN O N N H N IC50 = 0.0095 nM 535.65 CCCC(=O)Nc1cccc(-c2nc(Nc3ccc4[nH]ncc4c3)c3cc(OCCN4CCCC4)ccc3n2)c1 Homo sapiens CHEMBL3705523 single protein format
CHEMBL3666722 OBDepict CH 3 N H O N N N H O N N H N N H 3 C IC50 = 0.0095 nM 564.69 CCCC(=O)Nc1cccc(-c2nc(Nc3ccc4[nH]ncc4c3)c3cc(OCCN4CCN(C)CC4)ccc3n2)c1 Homo sapiens CHEMBL3705523 single protein format
CHEMBL3666733 OBDepict CH 3 HN N H O N N N H N N H IC50 = 0.017 nM 423.48 CNCC(=O)Nc1ccccc1-c1nc(Nc2ccc3[nH]ncc3c2)c2ccccc2n1 Homo sapiens CHEMBL3705523 single protein format
CHEMBL3666753 OBDepict CH 3 O O N N N H N N H IC50 = 0.023 nM 395.42 CC(=O)Oc1ccccc1-c1nc(Nc2ccc3[nH]ncc3c2)c2ccccc2n1 Homo sapiens CHEMBL3705523 single protein format
CHEMBL3666735 OBDepict O HN N N N N H N N H IC50 = 0.036 nM 463.55 O=C(CN1CCCC1)Nc1ccccc1-c1nc(Nc2ccc3[nH]ncc3c2)c2ccccc2n1 Homo sapiens CHEMBL3705523 single protein format
CHEMBL3666738 OBDepict H 3 C N CH 3 N H O N N N H N N H IC50 = 0.049 nM 423.48 CN(C)C(=O)Nc1ccccc1-c1nc(Nc2ccc3[nH]ncc3c2)c2ccccc2n1 Homo sapiens CHEMBL3705523 single protein format
CHEMBL3680738 OBDepict H 3 C N N H O NH O S N N H IC50 = 0.17 nM 471.59 CN1CCc2ccc(NC(=O)c3cccc(CNC(=O)c4ccc(-c5cn[nH]c5)s4)c3)cc2C1 Homo sapiens CHEMBL3705211 single protein format
CHEMBL3680755 OBDepict CH 3 N S N HN O N H O S N IC50 = 0.18 nM 489.63 CN1CCc2nc(NC(=O)c3cccc(CNC(=O)c4ccc(-c5ccncc5)s4)c3)sc2C1 Homo sapiens CHEMBL3705211 single protein format
CHEMBL3578252 OBDepict CH 3 O N N H O H 3 C H O CH 3 IC50 = 0.18 nM 388.47 CCC1Oc2cnccc2-c2ccc(C(=O)N[C@H](C)c3cccc(OC)c3)cc21 Homo sapiens CHEMBL3578767 single protein format
CHEMBL3949136 OBDepict H 3 C O HN O N N H HN O N CH 3 IC50 = 0.19 nM 447.54 COc1cc(C(=O)NCc2cccc(C(=O)NC3CCN(C)CC3)c2)ccc1-c1cn[nH]c1 Homo sapiens CHEMBL3889186 single protein format
CHEMBL4753043 OBDepict OH H NH O NH 2 N Ki = 0.2 nM 321.38 NC[C@@H](C(=O)Nc1ccc2cnccc2c1)c1ccc(CO)cc1 Homo sapiens CHEMBL4668587 assay format
CHEMBL3792888 OBDepict HO HN O NH 2 N Ki = 0.2 nM 321.38 NCC(C(=O)Nc1ccc2cnccc2c1)c1ccc(CO)cc1 Homo sapiens CHEMBL3796494 single protein format
CHEMBL3680772 OBDepict CH 3 N CH 3 H S N HN O N H O O N IC50 = 0.2 nM 501.61 CN(C)[C@H]1CCc2nc(NC(=O)c3cccc(CNC(=O)c4ccc(-c5cnco5)cc4)c3)sc2C1 Homo sapiens CHEMBL3705211 single protein format
CHEMBL3680805 OBDepict H 3 C N CH 3 H S N NH O N H O N H N N IC50 = 0.2 nM 501.62 CN(C)[C@H]1CCc2nc(NC(=O)c3cccc(CNC(=O)c4cc(-c5ccncc5)n[nH]4)c3)sc2C1 Homo sapiens CHEMBL3705211 single protein format
CHEMBL3680698 OBDepict CH 3 N S N HN O N H O O N IC50 = 0.21 nM 473.56 CN1CCc2nc(NC(=O)c3cccc(CNC(=O)c4ccc(-c5cnco5)cc4)c3)sc2C1 Homo sapiens CHEMBL3705211 single protein format
CHEMBL3680773 OBDepict O N H S N N H O H N N CH 3 CH 3 N N N O NH 2 N IC50 = 0.21 nM 584.67 CN(C)[C@H]1CCc2nc(NC(=O)c3cccc(CNC(=O)c4nnn(-c5nonc5N)c4-c4ccccc4)c3)sc2C1 Homo sapiens CHEMBL3705211 single protein format
CHEMBL4763198 OBDepict H 3 C O HN CH 3 H O H 3 C O N IC50 = 0.21 nM 374.44 COc1cccc([C@@H](C)NC(=O)c2ccc3c(c2)C(C)Oc2cnccc2-3)c1 Homo sapiens CHEMBL4669834 single protein format
CHEMBL3680752 OBDepict O HN S N N H O H N CH 3 CH 3 N IC50 = 0.22 nM 511.65 CN(C)[C@H]1CCc2nc(NC(=O)c3cccc(CNC(=O)c4ccc(-c5ccncc5)cc4)c3)sc2C1 Homo sapiens CHEMBL3705211 single protein format
CHEMBL3680768 OBDepict H N N S N H O N H O S N H N H 3 C H 3 C IC50 = 0.22 nM 506.66 CN(C)[C@H]1CCc2nc(NC(=O)c3cccc(CNC(=O)c4ccc(-c5cn[nH]c5)s4)c3)sc2C1 Homo sapiens CHEMBL3705211 single protein format
CHEMBL3902471 OBDepict H 3 C O N H O N N H N H O N S N H IC50 = 0.23 nM 488.57 COc1cc(C(=O)NCc2cccc(C(=O)Nc3nc4c(s3)CNCC4)c2)ccc1-c1cn[nH]c1 Homo sapiens CHEMBL3889186 single protein format
CHEMBL3680771 OBDepict H 3 C N CH 3 H S N NH O N H O N N IC50 = 0.24 nM 500.63 CN(C)[C@H]1CCc2nc(NC(=O)c3cccc(CNC(=O)c4ccc(-n5ccnc5)cc4)c3)sc2C1 Homo sapiens CHEMBL3705211 single protein format
CHEMBL3680735 OBDepict CH 3 N N H O HN O S N IC50 = 0.25 nM 482.61 CN1CCc2ccc(NC(=O)c3cccc(CNC(=O)c4ccc(-c5ccncc5)s4)c3)cc2C1 Homo sapiens CHEMBL3705211 single protein format
CHEMBL3680804 OBDepict O N H S N N H O H N S H 3 C H 3 C H 3 C N N IC50 = 0.25 nM 532.7 Cc1nc(-c2ccncc2)sc1C(=O)NCc1cccc(C(=O)Nc2nc3c(s2)C[C@@H](N(C)C)CC3)c1 Homo sapiens CHEMBL3705211 single protein format
CHEMBL3680740 OBDepict H 3 C N N H O NH O N H 3 C O NH 2 IC50 = 0.26 nM 495.58 CN1CCc2ccc(NC(=O)c3cccc(CNC(=O)c4cc5ccc(C(N)=O)cc5n4C)c3)cc2C1 Homo sapiens CHEMBL3705211 single protein format
CHEMBL3680728 OBDepict CH 3 N S N HN O N H O N IC50 = 0.26 nM 483.6 CN1CCc2nc(NC(=O)c3cccc(CNC(=O)c4ccc(-c5ccncc5)cc4)c3)sc2C1 Homo sapiens CHEMBL3705211 single protein format
CHEMBL3680765 OBDepict O N H S N N H O H N S CH 3 CH 3 N IC50 = 0.27 nM 517.68 CN(C)[C@H]1CCc2nc(NC(=O)c3cccc(CNC(=O)c4ccc(-c5ccncc5)s4)c3)sc2C1 Homo sapiens CHEMBL3705211 single protein format
CHEMBL3680748 OBDepict N N N N H O N H O N S H N H 3 C H 3 C IC50 = 0.27 nM 499.6 CN(C)[C@H]1CCc2nc(NC(=O)c3cccc(CNC(=O)c4cn5ccc(C#N)cc5n4)c3)sc2C1 Homo sapiens CHEMBL3705211 single protein format
CHEMBL4114628 OBDepict H 2 N N H H O O CH 3 N N H IC50 = 0.28 nM 336.4 COc1cc(C(=O)N[C@H](CN)c2ccccc2)ccc1-c1cn[nH]c1 Homo sapiens CHEMBL3889186 single protein format
CHEMBL3700932 OBDepict N NH N O H HN O S N H N CH 3 CH 3 IC50 = 0.3 nM 514.66 CN(C)[C@H]1CCc2nc(NC(=O)c3cccc([C@H]4CCCN4C(=O)Nc4cccc(C#N)c4)c3)sc2C1 Homo sapiens CHEMBL3705771 single protein format
CHEMBL3968772 OBDepict O N H N H 3 C CH 3 N N H O IC50 = 0.3 nM 384.44 CN(C)c1ccc(C(=O)Nc2ccc(-c3n[nH]c(=O)c4ccccc34)cc2)cc1 Homo sapiens CHEMBL3887752 single protein format
CHEMBL3680753 OBDepict O N H S N N H O H N N CH 3 CH 3 S N IC50 = 0.32 nM 518.67 CN(C)[C@H]1CCc2nc(NC(=O)c3cccc(CNC(=O)c4csc(-c5cccnc5)n4)c3)sc2C1 Homo sapiens CHEMBL3705211 single protein format
CHEMBL3680769 OBDepict H N N HN O HN O S N H N CH 3 CH 3 IC50 = 0.32 nM 500.63 CN(C)[C@H]1CCc2nc(NC(=O)c3cccc(CNC(=O)c4cccc(-c5cn[nH]c5)c4)c3)sc2C1 Homo sapiens CHEMBL3705211 single protein format
CHEMBL3947008 OBDepict H 3 C O HN O N N H HN O IC50 = 0.32 nM 390.44 COc1cc(C(=O)NCc2cccc(C(=O)NC3CC3)c2)ccc1-c1cn[nH]c1 Homo sapiens CHEMBL3889186 single protein format
CHEMBL3961538 OBDepict CH 3 O N H O N N H N H O S N N H 3 C IC50 = 0.33 nM 502.6 COc1cc(C(=O)NCc2cccc(C(=O)Nc3nc4c(s3)CN(C)CC4)c2)ccc1-c1cn[nH]c1 Homo sapiens CHEMBL3889186 single protein format
CHEMBL3680775 OBDepict O N H S N N H O H N N H 3 C H 3 C N H 3 C N N O NH 2 N IC50 = 0.33 nM 522.6 Cc1c(C(=O)NCc2cccc(C(=O)Nc3nc4c(s3)C[C@@H](N(C)C)CC4)c2)nnn1-c1nonc1N Homo sapiens CHEMBL3705211 single protein format
CHEMBL3680786 OBDepict O N H N S HN O H N N H N O N IC50 = 0.34 nM 543.65 O=C(Nc1nc2c(s1)C[C@@H](N1CCOCC1)CC2)c1cccc(CNC(=O)c2cc(-c3ccncc3)n[nH]2)c1 Homo sapiens CHEMBL3705211 single protein format
CHEMBL4785041 OBDepict H 3 C O HN CH 3 H O O N IC50 = 0.35 nM 360.41 COc1cccc([C@@H](C)NC(=O)c2ccc3c(c2)COc2cnccc2-3)c1 Homo sapiens CHEMBL4669834 single protein format
CHEMBL3680790 OBDepict O N H N S N H O H N O N N N CH 3 N IC50 = 0.35 nM 558.67 Cc1nnnn1-c1ccc(C(=O)NCc2cccc(C(=O)Nc3nc4c(s3)C[C@@H](N3CCOCC3)CC4)c2)cc1 Homo sapiens CHEMBL3705211 single protein format
CHEMBL3925017 OBDepict CH 3 O HN O N N H HN O N CH 3 IC50 = 0.36 nM 447.54 COc1cc(-c2cn[nH]c2)ccc1C(=O)NCc1cccc(C(=O)NC2CCN(C)CC2)c1 Homo sapiens CHEMBL3889186 single protein format
CHEMBL3964418 OBDepict H 2 N N H O O CH 3 N N H IC50 = 0.36 nM 350.42 COc1cc(C(=O)NC(CN)Cc2ccccc2)ccc1-c1cn[nH]c1 Homo sapiens CHEMBL3889186 single protein format
CHEMBL3680766 OBDepict O N H S N N H O H N S H 3 C CH 3 O N IC50 = 0.37 nM 507.64 CN(C)[C@H]1CCc2nc(NC(=O)c3cccc(CNC(=O)c4ccc(-c5cnco5)s4)c3)sc2C1 Homo sapiens CHEMBL3705211 single protein format
CHEMBL3910152 OBDepict CH 3 O HN O N N H N H O IC50 = 0.37 nM 404.47 COc1cc(C(=O)NCc2cccc(C(=O)NCC3CC3)c2)ccc1-c1cn[nH]c1 Homo sapiens CHEMBL3889186 single protein format
CHEMBL3680787 OBDepict O N H N S N H O H N S H 3 C N O N IC50 = 0.37 nM 574.73 Cc1nc(-c2ccncc2)sc1C(=O)NCc1cccc(C(=O)Nc2nc3c(s2)C[C@@H](N2CCOCC2)CC3)c1 Homo sapiens CHEMBL3705211 single protein format
CHEMBL3680789 OBDepict O NH N S N H O H N O N N IC50 = 0.38 nM 542.67 O=C(NCc1cccc(C(=O)Nc2nc3c(s2)C[C@@H](N2CCOCC2)CC3)c1)c1ccc(-n2ccnc2)cc1 Homo sapiens CHEMBL3705211 single protein format
CHEMBL3680701 OBDepict CH 3 N S N HN O N H O OH IC50 = 0.39 nM 472.57 CN1CCc2nc(NC(=O)c3cccc(CNC(=O)c4ccc5cc(O)ccc5c4)c3)sc2C1 Homo sapiens CHEMBL3705211 single protein format
CHEMBL3792673 OBDepict NH 2 HN O H 3 C N Ki = 0.4 nM 305.38 Cc1ccc(C(CN)C(=O)Nc2ccc3cnccc3c2)cc1 Homo sapiens CHEMBL3796494 single protein format
CHEMBL3794104 OBDepict NH 2 HN O Cl N Ki = 0.4 nM 325.8 NCC(C(=O)Nc1ccc2cnccc2c1)c1ccc(Cl)cc1 Homo sapiens CHEMBL3796494 single protein format
CHEMBL3793004 OBDepict NH 2 H NH O N Ki = 0.4 nM 291.35 NC[C@@H](C(=O)Nc1ccc2cnccc2c1)c1ccccc1 Homo sapiens CHEMBL3796494 single protein format
CHEMBL4791701 OBDepict CH 3 N H O N N H CH 3 H O CH 3 IC50 = 0.4 nM 349.43 CCc1cc(C(=O)N[C@H](C)c2cccc(OC)c2)ccc1-c1cn[nH]c1 Homo sapiens CHEMBL4669819 single protein format
CHEMBL3956238 OBDepict H 3 C HN O HN O O CH 3 N N H IC50 = 0.4 nM 378.43 CCNC(=O)c1cccc(CNC(=O)c2ccc(-c3cn[nH]c3)c(OC)c2)c1 Homo sapiens CHEMBL3889186 single protein format
CHEMBL1080279 OBDepict H 3 C O N O N S N H 3 C CH 3 N N H IC50 = 0.4 nM 435.55 COc1cccc(CN(CCN(C)C)C(=O)c2nc3ccc(-c4cn[nH]c4)cc3s2)c1 Homo sapiens CHEMBL1102485 single protein format
CHEMBL3680788 OBDepict H N N N H O N H O N S H N O IC50 = 0.41 nM 542.67 O=C(NCc1cccc(C(=O)Nc2nc3c(s2)C[C@@H](N2CCOCC2)CC3)c1)c1cccc(-c2cn[nH]c2)c1 Homo sapiens CHEMBL3705211 single protein format
CHEMBL3680784 OBDepict O NH N S N H O H N O O N IC50 = 0.43 nM 543.65 O=C(NCc1cccc(C(=O)Nc2nc3c(s2)C[C@@H](N2CCOCC2)CC3)c1)c1ccc(-c2cnco2)cc1 Homo sapiens CHEMBL3705211 single protein format
CHEMBL3680751 OBDepict CH 3 N H 3 C H S N HN O HN O N N N CH 3 N IC50 = 0.43 nM 516.63 Cc1nnnn1-c1ccc(C(=O)NCc2cccc(C(=O)Nc3nc4c(s3)C[C@@H](N(C)C)CC4)c2)cc1 Homo sapiens CHEMBL3705211 single protein format
CHEMBL3680756 OBDepict CH 3 N S N HN O N H O S O N IC50 = 0.45 nM 479.59 CN1CCc2nc(NC(=O)c3cccc(CNC(=O)c4ccc(-c5cnco5)s4)c3)sc2C1 Homo sapiens CHEMBL3705211 single protein format
CHEMBL3218297 OBDepict CH 3 S O O HO O N H N H S N OH N IC50 = 0.45 nM 422.49 CS(=O)(=O)O.O=C(NCc1cccc(O)c1)Nc1nc(-c2ccncc2)cs1 Homo sapiens CHEMBL3226384 single protein format
CHEMBL3961024 OBDepict H 3 C O NH O N N H NH O OH H 3 C H 3 C IC50 = 0.46 nM 422.49 COc1cc(C(=O)NCc2cccc(C(=O)NCC(C)(C)O)c2)ccc1-c1cn[nH]c1 Homo sapiens CHEMBL3889186 single protein format
CHEMBL3892516 OBDepict CH 3 N N N HN O N H O Ki = 0.49 nM 493.61 CN1CCN(Cc2ccc3c(c2)CN(C(=O)Nc2ccc(-c4c[nH]c(=O)c5ccccc45)cc2)C3)CC1 Homo sapiens CHEMBL3888192 single protein format
CHEMBL4747999 OBDepict CH 3 N H HN O N H O H 3 C O N IC50 = 0.5 nM 484.6 CCN1CCC[C@H]1CNC(=O)c1cccc(CNC(=O)c2ccc3c(c2)C(C)Oc2cnccc2-3)c1 Homo sapiens CHEMBL4669834 single protein format
CHEMBL3977577 OBDepict H N N CH 3 HN O N H O IC50 = 0.5 nM 388.47 Cc1cc(C(=O)NCc2cccc(C(=O)NCC3CC3)c2)ccc1-c1cn[nH]c1 Homo sapiens CHEMBL3889186 single protein format
CHEMBL3578250 OBDepict H 3 C O HN CH 3 H O O N IC50 = 0.51 nM 360.41 COc1cccc([C@@H](C)NC(=O)c2ccc3c(c2)OCc2cnccc2-3)c1 Homo sapiens CHEMBL3578767 single protein format
CHEMBL4461288 OBDepict CH 3 O B N OH HO N N H IC50 = 0.51 nM 359.19 COc1c(B(O)O)cccc1-c1nc2ccc3[nH]ncc3c2c2c1CCC2 Homo sapiens CHEMBL4361939 single protein format
CHEMBL3680779 OBDepict N N N HN O NH O N S H N O IC50 = 0.52 nM 541.64 N#Cc1ccn2cc(C(=O)NCc3cccc(C(=O)Nc4nc5c(s4)C[C@@H](N4CCOCC4)CC5)c3)nc2c1 Homo sapiens CHEMBL3705211 single protein format
CHEMBL3792663 OBDepict NH 2 HN O HO N Ki = 0.6 nM 307.35 NCC(C(=O)Nc1ccc2cnccc2c1)c1ccc(O)cc1 Homo sapiens CHEMBL3796494 single protein format
CHEMBL3700934 OBDepict N N H N O H N H O N S H N O IC50 = 0.6 nM 556.69 N#Cc1cccc(NC(=O)N2CCC[C@@H]2c2cccc(C(=O)Nc3nc4c(s3)C[C@@H](N3CCOCC3)CC4)c2)c1 Homo sapiens CHEMBL3705771 single protein format
CHEMBL4115244 OBDepict CH 3 O N H O N H 3 C N H 3 C H H O CH 3 IC50 = 0.65 nM 365.43 COc1cccc([C@@H](C)NC(=O)c2ccc(-c3c[nH]nc3C)cc2OC)c1 Homo sapiens CHEMBL3889186 single protein format
CHEMBL4109840 OBDepict CH 3 O N H H 3 C H O Cl N N H IC50 = 0.67 nM 355.83 COc1cccc([C@@H](C)NC(=O)c2ccc(-c3cn[nH]c3)c(Cl)c2)c1 Homo sapiens CHEMBL3889186 single protein format
CHEMBL3793497 OBDepict H 2 N NH O N Ki = 0.7 nM 341.41 NCC(C(=O)Nc1ccc2cnccc2c1)c1ccc2ccccc2c1 Homo sapiens CHEMBL3796494 single protein format
CHEMBL482336 OBDepict CH 3 O O N H O O N N N CH 3 CH 3 H IC50 = 0.7 nM 436.51 COc1ccc2c(c1)CC(C(=O)Nc1ccc(-c3cn[nH]c3)cc1OCCN(C)C)CO2 Homo sapiens CHEMBL4481805 single protein format
CHEMBL3793788 OBDepict H 2 N N H O O N O N Ki = 0.7 nM 426.48 NCC(C(=O)Nc1ccc2cnccc2c1)c1ccc(COC(=O)c2cccnc2)cc1 Homo sapiens CHEMBL3796494 single protein format
CHEMBL4107343 OBDepict H N N CH 3 HN O HN O H N H IC50 = 0.71 nM 417.51 Cc1cc(C(=O)NCc2cccc(C(=O)NC[C@H]3CCCN3)c2)ccc1-c1cn[nH]c1 Homo sapiens CHEMBL3889186 single protein format
CHEMBL4107839 OBDepict NH 2 N H H O CH 3 N N H IC50 = 0.72 nM 320.4 Cc1cc(C(=O)N[C@H](CN)c2ccccc2)ccc1-c1cn[nH]c1 Homo sapiens CHEMBL3889186 single protein format
CHEMBL4749267 OBDepict CH 3 O N H H 3 C H O O N IC50 = 0.72 nM 400.48 COc1cccc([C@@H](C)NC(=O)c2ccc3c(c2)C(C2CC2)Oc2cnccc2-3)c1 Homo sapiens CHEMBL4669834 single protein format
CHEMBL3985772 OBDepict H 3 C O HN O N N H O NH 2 IC50 = 0.72 nM 350.38 COc1cc(C(=O)NCc2cccc(C(N)=O)c2)ccc1-c1cn[nH]c1 Homo sapiens CHEMBL3889186 single protein format
CHEMBL3680709 OBDepict H N N HN O HN O N S H NH 2 IC50 = 0.72 nM 472.57 N[C@H]1CCc2nc(NC(=O)c3cccc(CNC(=O)c4cccc(-c5cn[nH]c5)c4)c3)sc2C1 Homo sapiens CHEMBL3705212 single protein format
CHEMBL3680778 OBDepict O N H N S N H O H N N S O N IC50 = 0.73 nM 560.71 O=C(Nc1nc2c(s1)C[C@@H](N1CCOCC1)CC2)c1cccc(CNC(=O)c2csc(-c3cccnc3)n2)c1 Homo sapiens CHEMBL3705211 single protein format
CHEMBL3680760 OBDepict CH 3 N S N HN O N H O S N N H IC50 = 0.77 nM 478.6 CN1CCc2nc(NC(=O)c3cccc(CNC(=O)c4ccc(-c5cn[nH]c5)s4)c3)sc2C1 Homo sapiens CHEMBL3705211 single protein format
CHEMBL3793404 OBDepict NH 2 HN O Cl Cl N Ki = 0.8 nM 360.24 NCC(C(=O)Nc1ccc2cnccc2c1)c1ccc(Cl)cc1Cl Homo sapiens CHEMBL3796494 single protein format
CHEMBL3770836 OBDepict H 2 N NH O N Ki = 0.8 nM 291.35 NCC(C(=O)Nc1ccc2cnccc2c1)c1ccccc1 Homo sapiens CHEMBL3796494 single protein format
CHEMBL4758151 OBDepict H 3 C NH O HN O CH 3 O N IC50 = 0.8 nM 401.47 CCNC(=O)c1cccc(CNC(=O)c2ccc3c(c2)C(C)Oc2cnccc2-3)c1 Homo sapiens CHEMBL4669834 single protein format
CHEMBL3700920 OBDepict CH 3 N S N HN O O NH O N N H IC50 = 0.8 nM 462.54 CN1CCc2nc(NC(=O)c3cccc(OCC(=O)Nc4ccc5[nH]ncc5c4)c3)sc2C1 Homo sapiens CHEMBL3705771 single protein format
CHEMBL3700969 OBDepict CH 3 N H 3 C H S N N H O H N O N N H N IC50 = 0.8 nM 541.68 CN(C)[C@H]1CCc2nc(NC(=O)c3cccc([C@H]4CCCN4C(=O)c4cc(-c5ccncc5)[nH]n4)c3)sc2C1 Homo sapiens CHEMBL3705771 single protein format
CHEMBL4790421 OBDepict H 3 C NH O HN O O N IC50 = 0.8 nM 387.44 CCNC(=O)c1cccc(CNC(=O)c2ccc3c(c2)COc2cnccc2-3)c1 Homo sapiens CHEMBL4669834 single protein format
CHEMBL3793029 OBDepict NH 2 N H O O N O Ki = 0.8 nM 439.52 NCC(C(=O)Nc1ccc2cnccc2c1)c1ccc(COC(=O)Cc2ccccc2)cc1 Homo sapiens CHEMBL3796494 single protein format
CHEMBL3928198 OBDepict CH 3 O O F HN O O CH 3 N N H IC50 = 0.82 nM 383.38 COC(=O)c1cc(CNC(=O)c2ccc(-c3cn[nH]c3)c(OC)c2)ccc1F Homo sapiens CHEMBL3889186 single protein format
CHEMBL3913336 OBDepict CH 3 O N H O N N H H 3 C H O CH 3 IC50 = 0.85 nM 351.41 COc1cccc([C@@H](C)NC(=O)c2ccc(-c3cn[nH]c3)c(OC)c2)c1 Homo sapiens CHEMBL3889186 single protein format
CHEMBL4749353 OBDepict H 3 C N NH O HN O O N IC50 = 0.85 nM 428.49 CN1CC(NC(=O)c2cccc(CNC(=O)c3ccc4c(c3)COc3cnccc3-4)c2)C1 Homo sapiens CHEMBL4669834 single protein format