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Q00987 | MDM2_HUMAN | E3 ubiquitin-protein ligase Mdm2 (MDM2)

3D structures mapped by conservation among orthologs

[ Domain: "Rubredoxin-related" // zf-RanBP ]

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[ Domain: "RING/U-box" // zf-C3HC4_3 ]

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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
CHEMBL3653245 OBDepict HO O N N H 3 C H 3 C CH 3 O N H CH 3 CH 3 Cl Cl IC50 = 0.04 nM 550.49 COc1ccc(CO)cc1-c1nc2c(n1C(C)C)[C@H](c1ccc(Cl)cc1C)N(c1cc(Cl)ccc1C)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL4463050 OBDepict OH O H O N H H S H O O H 3 C H 3 C H 3 C H 3 C Cl Cl Ki = 0.045 nM 540.51 CC(C)[C@H](N1C(=O)[C@@H](CC(=O)O)C[C@@H](c2cccc(Cl)c2)[C@H]1c1ccc(Cl)cc1)S(=O)(=O)C(C)C Homo sapiens CHEMBL4353006 cell-based format
CHEMBL3657124 OBDepict H 3 C O N CH 3 H N H N N O N O H 3 C N N H 3 C CH 3 Cl Cl CH 3 O IC50 = 0.059 nM 598.49 COC[C@@H](C)n1c(-c2cnc(N(C)C)nc2OC)nc2c1[C@H](c1ccc(Cl)cc1)N(c1cc(Cl)c(=O)n(C)c1)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3318761 OBDepict OH O H 3 C O N H H H S Cl HN O O Cl IC50 = 0.059 nM 579.55 C[C@]1(CC(=O)O)C[C@H](c2cccc(Cl)c2)[C@@H](c2ccc(Cl)cc2)N([C@H](CS(=O)(=O)NC2CC2)C2CC2)C1=O Homo sapiens CHEMBL3370341 single protein format
CHEMBL3691776 OBDepict CH 3 O N N N N N H 3 C CH 3 H 3 C CH 3 O N H O N Cl H Cl IC50 = 0.068 nM 554.44 COc1nc(N(C)C)ncc1-n1nc2c(c1C(C)C)[C@H](c1ccc(Cl)cc1)N(c1cc(Cl)c[nH]c1=O)C2=O Homo sapiens CHEMBL3707807 single protein format
CHEMBL3653231 OBDepict CH 3 O N N O CH 3 N N H 3 C CH 3 O N H CH 3 CH 3 Cl Cl IC50 = 0.07 nM 552.46 COc1ncc(-c2nc3c(n2C(C)C)[C@H](c2ccc(Cl)cc2C)N(c2cc(Cl)ccc2C)C3=O)c(OC)n1 Homo sapiens CHEMBL3705464 single protein format
CHEMBL3653166 OBDepict CH 3 O N N N O H 3 C CH 3 CH 3 H 3 C O N H 3 C CH 3 Cl Cl IC50 = 0.07 nM 591.54 COc1ccc(C(=O)N(C)C)cc1-c1nc2c(n1C(C)C)C(c1ccc(Cl)cc1C)N(c1cc(Cl)ccc1C)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3639520 OBDepict CH 3 O N N HN H 3 C CH 3 O N O CH 3 H 3 C CH 3 Cl Cl IC50 = 0.07 nM 591.54 COc1ccc(CNC(C)=O)cc1-c1nc2c(n1C(C)C)C(c1ccc(Cl)cc1C)N(c1cc(Cl)ccc1C)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL4290086 OBDepict CH 3 O N N H 3 C CH 3 O N H H 3 C CH 3 Cl Cl IC50 = 0.074 nM 520.46 COc1ccccc1-c1nc2c(n1C(C)C)[C@H](c1ccc(Cl)cc1C)N(c1cc(Cl)ccc1C)C2=O Homo sapiens CHEMBL4267760 single protein format
CHEMBL3318756 OBDepict CH 3 HN S O O N H O H H 3 C H O HO Cl Cl IC50 = 0.079 nM 567.54 CCNS(=O)(=O)C[C@H](C1CC1)N1C(=O)[C@@](C)(CC(=O)O)C[C@H](c2cccc(Cl)c2)[C@H]1c1ccc(Cl)cc1 Homo sapiens CHEMBL3370341 single protein format
CHEMBL3656990 OBDepict CH 3 O N N O H 2 N H 3 C CH 3 O N Cl Cl F IC50 = 0.08 nM 553.42 COc1ccc(C(N)=O)cc1-c1nc2c(n1C(C)C)C(c1ccc(Cl)cc1)N(c1ccc(F)c(Cl)c1)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3657058 OBDepict CH 3 O N N N N N H 3 C CH 3 H 3 C CH 3 O N F F Cl N IC50 = 0.08 nM 564.0 COc1nc(N(C)C)ncc1-c1nc2c(n1C(C)C)C(c1ccc(C#N)c(F)c1)N(c1cccc(Cl)c1F)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3318758 OBDepict OH O H 3 C O N H H H S Cl HN O O Cl IC50 = 0.081 nM 593.57 C[C@]1(CC(=O)O)C[C@H](c2cccc(Cl)c2)[C@@H](c2ccc(Cl)cc2)N([C@H](CS(=O)(=O)NCC2CC2)C2CC2)C1=O Homo sapiens CHEMBL3370341 single protein format
CHEMBL3657083 OBDepict CH 3 O N N N N N H 3 C CH 3 H 3 C CH 3 O N H O N Cl CH 3 Cl IC50 = 0.081 nM 568.47 COc1nc(N(C)C)ncc1-c1nc2c(n1C(C)C)[C@H](c1ccc(Cl)cc1)N(c1cc(Cl)cn(C)c1=O)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3318762 OBDepict HO O CH 3 O N H H H S Cl HN O O Cl IC50 = 0.086 nM 593.57 C[C@]1(CC(=O)O)C[C@H](c2cccc(Cl)c2)[C@@H](c2ccc(Cl)cc2)N([C@H](CS(=O)(=O)NC2CCC2)C2CC2)C1=O Homo sapiens CHEMBL3370341 single protein format
CHEMBL3657117 OBDepict H 3 C O N CH 3 H N H N N O N O H 3 C O H 3 C Cl Cl F IC50 = 0.089 nM 572.42 COC[C@@H](C)n1c(-c2cnc(OC)nc2OC)nc2c1[C@H](c1ccc(Cl)cc1)N(c1ccc(F)c(Cl)c1)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3653173 OBDepict H 2 N O N N H 3 C H 3 C CH 3 O N H 3 C CH 3 Cl Cl IC50 = 0.09 nM 549.5 COc1ccc(CN)cc1-c1nc2c(n1C(C)C)C(c1ccc(Cl)cc1C)N(c1cc(Cl)ccc1C)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3653271 OBDepict CH 3 O N N O CH 3 N N CH 3 H O N OH CH 3 Cl Cl IC50 = 0.09 nM 554.43 COc1ncc(-c2nc3c(n2[C@H](C)CO)C(c2ccc(Cl)cc2)N(c2cc(Cl)ccc2C)C3=O)c(OC)n1 Homo sapiens CHEMBL3705464 single protein format
CHEMBL3657024 OBDepict CH 3 O N N N H O H 3 C CH 3 O N H 3 C H 3 C CH 3 Cl Cl IC50 = 0.09 nM 591.54 COc1ccc(C(=O)NC(C)C)cc1-c1nc2c(n1C(C)C)C(c1ccc(Cl)cc1)N(c1cc(Cl)ccc1C)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3657035 OBDepict CH 3 O N N N O H 3 C CH 3 CH 3 H 3 C O N H CH 3 CH 3 Cl Cl IC50 = 0.09 nM 591.54 COc1ccc(C(=O)N(C)C)cc1-c1nc2c(n1C(C)C)[C@H](c1ccc(Cl)cc1C)N(c1cc(Cl)ccc1C)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3318764 OBDepict HO O CH 3 O N H H H S Cl N H O O CH 3 CH 3 H 3 C Cl IC50 = 0.091 nM 595.59 CC(C)(C)NS(=O)(=O)C[C@H](C1CC1)N1C(=O)[C@@](C)(CC(=O)O)C[C@H](c2cccc(Cl)c2)[C@H]1c1ccc(Cl)cc1 Homo sapiens CHEMBL3370341 single protein format
CHEMBL3691779 OBDepict CH 3 O N N N N N H 3 C CH 3 H 3 C CH 3 O N H O N Cl H N IC50 = 0.097 nM 545.0 COc1nc(N(C)C)ncc1-n1nc2c(c1C(C)C)[C@H](c1ccc(C#N)cc1)N(c1cc(Cl)c[nH]c1=O)C2=O Homo sapiens CHEMBL3707807 single protein format
CHEMBL3318760 OBDepict HO O CH 3 O N H H H S Cl N H O O H 3 C CH 3 Cl IC50 = 0.098 nM 581.56 CC(C)NS(=O)(=O)C[C@H](C1CC1)N1C(=O)[C@@](C)(CC(=O)O)C[C@H](c2cccc(Cl)c2)[C@H]1c1ccc(Cl)cc1 Homo sapiens CHEMBL3370341 single protein format
CHEMBL3236364 OBDepict H 2 N O CH 3 O N H H H S Cl O O CH 3 CH 3 CH 3 Cl IC50 = 0.1 nM 579.59 CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1C(=O)[C@@](C)(CC(N)=O)C[C@H](c2cccc(Cl)c2)[C@H]1c1ccc(Cl)cc1 Homo sapiens CHEMBL3241171 assay format
CHEMBL3125521 OBDepict OH O H 3 C O N H H H S Cl N O O Cl IC50 = 0.1 nM 593.57 C[C@]1(CC(=O)O)C[C@H](c2cccc(Cl)c2)[C@@H](c2ccc(Cl)cc2)N([C@H](CS(=O)(=O)N2CCCC2)C2CC2)C1=O Homo sapiens CHEMBL3132470 single protein format
CHEMBL3125534 OBDepict HO O CH 3 O N H H CH 3 H S Cl O O H 3 C H 3 C CH 3 Cl IC50 = 0.1 nM 554.54 C[C@@H](CS(=O)(=O)C(C)(C)C)N1C(=O)[C@@](C)(CC(=O)O)C[C@H](c2cccc(Cl)c2)[C@H]1c1ccc(Cl)cc1 Homo sapiens CHEMBL3132470 single protein format
CHEMBL3656982 OBDepict CH 3 O N N N N N H 3 C CH 3 H 3 C CH 3 O N H OH N Cl Cl IC50 = 0.1 nM 554.44 COc1nc(N(C)C)ncc1-c1nc2c(n1C(C)C)[C@H](c1ccc(Cl)cc1)N(c1cc(Cl)cnc1O)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3125537 OBDepict HO O CH 3 O N H H H S Cl O O CH 3 CH 3 CH 3 Cl IC50 = 0.1 nM 580.57 CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1C(=O)[C@@](C)(CC(=O)O)C[C@H](c2cccc(Cl)c2)[C@H]1c1ccc(Cl)cc1 Homo sapiens CHEMBL3132470 single protein format
CHEMBL3125538 OBDepict OH O H 3 C O N H H H S Cl O O H 3 C CH 3 H 3 C Cl IC50 = 0.1 nM 594.6 CC(C)(C)S(=O)(=O)C[C@H](C1CCC1)N1C(=O)[C@@](C)(CC(=O)O)C[C@H](c2cccc(Cl)c2)[C@H]1c1ccc(Cl)cc1 Homo sapiens CHEMBL3132470 single protein format
CHEMBL3125698 OBDepict OH O H 3 C O N H H H S Cl O O H 3 C H 3 C Cl IC50 = 0.1 nM 580.57 CC(C)S(=O)(=O)C[C@H](C1CCC1)N1C(=O)[C@@](C)(CC(=O)O)C[C@H](c2cccc(Cl)c2)[C@H]1c1ccc(Cl)cc1 Homo sapiens CHEMBL3132470 single protein format
CHEMBL3125701 OBDepict OH O H 3 C O N H H H S Cl O O CH 3 Cl IC50 = 0.1 nM 538.49 C[C@]1(CC(=O)O)C[C@H](c2cccc(Cl)c2)[C@@H](c2ccc(Cl)cc2)N([C@H](CS(C)(=O)=O)C2CC2)C1=O Homo sapiens CHEMBL3132470 single protein format
CHEMBL3236358 OBDepict CH 3 N H S O H O O H 3 C H 3 C CH 3 CH 3 H N N N H N Cl Cl IC50 = 0.1 nM 592.59 CC[C@@H](CS(=O)(=O)C(C)(C)C)N1C(=O)[C@@](C)(Cc2nnn[nH]2)C[C@H](c2cccc(Cl)c2)[C@H]1c1ccc(Cl)cc1 Homo sapiens CHEMBL3241171 assay format
CHEMBL3656992 OBDepict CH 3 O N N O H 2 N H 3 C CH 3 O N CH 3 Cl Cl IC50 = 0.1 nM 549.46 COc1ccc(C(N)=O)cc1-c1nc2c(n1C(C)C)C(c1ccc(Cl)cc1)N(c1cc(Cl)ccc1C)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3125520 OBDepict OH O H 3 C O N H H H S Cl N O O Cl IC50 = 0.1 nM 579.55 C[C@]1(CC(=O)O)C[C@H](c2cccc(Cl)c2)[C@@H](c2ccc(Cl)cc2)N([C@H](CS(=O)(=O)N2CCC2)C2CC2)C1=O Homo sapiens CHEMBL3132470 single protein format
CHEMBL3657084 OBDepict CH 3 O N N O CH 3 N N H 3 C CH 3 O N H OH N Cl Cl IC50 = 0.1015 nM 541.4 COc1ncc(-c2nc3c(n2C(C)C)[C@H](c2ccc(Cl)cc2)N(c2cc(Cl)cnc2O)C3=O)c(OC)n1 Homo sapiens CHEMBL3705464 single protein format
CHEMBL3691745 OBDepict CH 3 O N N N N N H 3 C CH 3 H 3 C CH 3 O N N Cl CH 3 Cl O IC50 = 0.103 nM 568.47 COc1nc(N(C)C)ncc1-n1nc2c(c1C(C)C)C(c1ccc(Cl)cc1)N(c1cc(Cl)c(=O)n(C)c1)C2=O Homo sapiens CHEMBL3707807 single protein format
CHEMBL3657116 OBDepict CH 3 O N N O CH 3 N N CH 3 H O N H OH F Cl Cl IC50 = 0.107 nM 558.4 COc1ncc(-c2nc3c(n2[C@H](C)CO)[C@H](c2ccc(Cl)cc2)N(c2cccc(Cl)c2F)C3=O)c(OC)n1 Homo sapiens CHEMBL3705464 single protein format
CHEMBL3318757 OBDepict H 3 C N H S O O N H O H CH 3 H O OH Cl Cl IC50 = 0.11 nM 581.56 CCCNS(=O)(=O)C[C@H](C1CC1)N1C(=O)[C@@](C)(CC(=O)O)C[C@H](c2cccc(Cl)c2)[C@H]1c1ccc(Cl)cc1 Homo sapiens CHEMBL3370341 single protein format
CHEMBL3657012 OBDepict CH 3 O N N N O H 3 C CH 3 CH 3 H 3 C O N Cl Cl F IC50 = 0.11 nM 581.48 COc1ccc(C(=O)N(C)C)cc1-c1nc2c(n1C(C)C)C(c1ccc(Cl)cc1)N(c1ccc(F)c(Cl)c1)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3653267 OBDepict CH 3 O N N N N N H 3 C CH 3 CH 3 H O N OH CH 3 Cl Cl IC50 = 0.11 nM 567.48 COc1nc(N(C)C)ncc1-c1nc2c(n1[C@H](C)CO)C(c1ccc(Cl)cc1)N(c1cc(Cl)ccc1C)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3656986 OBDepict CH 3 O N N O CH 3 N N H 3 C CH 3 O N H CH 3 Cl Cl IC50 = 0.11 nM 538.44 COc1ncc(-c2nc3c(n2C(C)C)[C@H](c2ccc(Cl)cc2)N(c2cc(Cl)ccc2C)C3=O)c(OC)n1 Homo sapiens CHEMBL3705464 single protein format
CHEMBL3653198 OBDepict CH 3 O N N N N N H 3 C CH 3 H 3 C H 3 C O N CH 3 Cl + N _ C IC50 = 0.11 nM 542.04 [C-]#[N+]c1ccc(C2c3c(nc(-c4cnc(N(C)C)nc4OC)n3C(C)C)C(=O)N2c2cc(Cl)ccc2C)cc1 Homo sapiens CHEMBL3705464 single protein format
CHEMBL3656991 OBDepict CH 3 O N N O H 2 N H 3 C CH 3 O N F Cl Cl IC50 = 0.11 nM 553.42 COc1ccc(C(N)=O)cc1-c1nc2c(n1C(C)C)C(c1ccc(Cl)cc1)N(c1cccc(Cl)c1F)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3657020 OBDepict CH 3 O N H 2 N N N N CH 3 H 3 C O N H CH 3 Cl Cl IC50 = 0.11 nM 523.42 COc1nc(N)ncc1-c1nc2c(n1C(C)C)[C@H](c1ccc(Cl)cc1)N(c1cc(Cl)ccc1C)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3657089 OBDepict CH 3 O N N N N N H 3 C CH 3 H 3 C CH 3 O N N F Cl CH 3 Cl O IC50 = 0.117 nM 586.46 COc1nc(N(C)C)ncc1-c1nc2c(n1C(C)C)C(c1ccc(Cl)c(F)c1)N(c1cc(Cl)c(=O)n(C)c1)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3691774 OBDepict CH 3 O N N N N N H 3 C CH 3 H 3 C CH 3 O N H N CH 3 Cl O N IC50 = 0.12 nM 559.03 COc1nc(N(C)C)ncc1-n1nc2c(c1C(C)C)[C@H](c1ccc(C#N)cc1)N(c1cc(Cl)c(=O)n(C)c1)C2=O Homo sapiens CHEMBL3707807 single protein format
CHEMBL3691744 OBDepict CH 3 O N N N N N H 3 C CH 3 H 3 C CH 3 O N O N Cl CH 3 Cl IC50 = 0.12 nM 568.47 COc1nc(N(C)C)ncc1-n1nc2c(c1C(C)C)C(c1ccc(Cl)cc1)N(c1cc(Cl)cn(C)c1=O)C2=O Homo sapiens CHEMBL3707807 single protein format
CHEMBL3653177 OBDepict OH O H 3 C N N H 3 C CH 3 O N CH 3 Cl Cl IC50 = 0.12 nM 536.46 COc1cc(CO)ccc1-c1nc2c(n1C(C)C)C(c1ccc(Cl)cc1)N(c1cc(Cl)ccc1C)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3657056 OBDepict CH 3 O N N N N N H 3 C CH 3 H 3 C CH 3 O N N CH 3 Cl Cl IC50 = 0.122 nM 552.47 COc1nc(N(C)C)ncc1-c1nc2c(n1C(C)C)C(c1ccc(Cl)cn1)N(c1cc(Cl)ccc1C)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3657107 OBDepict CH 3 O N N O CH 3 N N H 3 C CH 3 O N H N Cl CH 3 Cl O IC50 = 0.124 nM 555.42 COc1ncc(-c2nc3c(n2C(C)C)[C@H](c2ccc(Cl)cc2)N(c2cc(Cl)c(=O)n(C)c2)C3=O)c(OC)n1 Homo sapiens CHEMBL3705464 single protein format
CHEMBL3691790 OBDepict CH 3 O N N N N N H 3 C CH 3 H 3 C CH 3 O N O N F Cl CH 3 Cl IC50 = 0.128 nM 586.46 COc1nc(N(C)C)ncc1-n1nc2c(c1C(C)C)C(c1ccc(Cl)c(F)c1)N(c1cc(Cl)cn(C)c1=O)C2=O Homo sapiens CHEMBL3707807 single protein format
CHEMBL3691767 OBDepict CH 3 O N N N N N H 3 C CH 3 H 3 C CH 3 O N H O N Cl CH 3 N IC50 = 0.129 nM 559.03 COc1nc(N(C)C)ncc1-n1nc2c(c1C(C)C)[C@H](c1ccc(C#N)cc1)N(c1cc(Cl)cn(C)c1=O)C2=O Homo sapiens CHEMBL3707807 single protein format
CHEMBL3653178 OBDepict OH O H 3 C N N H 3 C CH 3 O N H 3 C CH 3 Cl Cl IC50 = 0.13 nM 550.49 COc1cc(CO)ccc1-c1nc2c(n1C(C)C)C(c1ccc(Cl)cc1C)N(c1cc(Cl)ccc1C)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3653192 OBDepict CH 3 O N N N N N H 3 C CH 3 H 3 C CH 3 O N CH 3 Cl Cl IC50 = 0.13 nM 551.48 COc1nc(N(C)C)ncc1-c1nc2c(n1C(C)C)C(c1ccc(Cl)cc1)N(c1cc(Cl)ccc1C)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3657005 OBDepict CH 3 O N N N O H 3 C CH 3 CH 3 H 3 C O N H CH 3 Cl Cl IC50 = 0.13 nM 577.51 COc1ccc(C(=O)N(C)C)cc1-c1nc2c(n1C(C)C)[C@H](c1ccc(Cl)cc1)N(c1cc(Cl)ccc1C)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3691752 OBDepict CH 3 O N N N N N H 3 C CH 3 H 3 C CH 3 O N N Cl H Cl O IC50 = 0.13 nM 554.44 COc1nc(N(C)C)ncc1-n1nc2c(c1C(C)C)C(c1ccc(Cl)cc1)N(c1c[nH]c(=O)c(Cl)c1)C2=O Homo sapiens CHEMBL3707807 single protein format
CHEMBL3653217 OBDepict CH 3 O N N N N N H 3 C H 3 C OH O N H 3 C Cl Cl IC50 = 0.13 nM 579.49 COc1nc(N2CC(O)C2)ncc1-c1nc2c(n1C(C)C)C(c1ccc(Cl)cc1)N(c1cc(Cl)ccc1C)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3691743 OBDepict CH 3 O N N N N N H 3 C CH 3 H 3 C CH 3 O N O N Cl H Cl IC50 = 0.13 nM 554.44 COc1nc(N(C)C)ncc1-n1nc2c(c1C(C)C)C(c1ccc(Cl)cc1)N(c1cc(Cl)c[nH]c1=O)C2=O Homo sapiens CHEMBL3707807 single protein format
CHEMBL3657059 OBDepict N N O N N CH 3 H 3 C CH 3 O N H F Cl Cl IC50 = 0.13 nM 550.42 COc1cnc(CC#N)cc1-c1nc2c(n1C(C)C)[C@H](c1ccc(Cl)cc1)N(c1cccc(Cl)c1F)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3653179 OBDepict CH 3 O N N N O H 3 C CH 3 CH 3 H 3 C O N CH 3 Cl Cl IC50 = 0.13 nM 577.51 COc1ccc(C(=O)N(C)C)cc1-c1nc2c(n1C(C)C)C(c1ccc(Cl)cc1)N(c1cc(Cl)ccc1C)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3657122 OBDepict H 3 C O N CH 3 H N H N N O N O H 3 C O N H 3 C Cl Cl CH 3 O IC50 = 0.135 nM 585.45 COC[C@@H](C)n1c(-c2cnc(OC)nc2OC)nc2c1[C@H](c1ccc(Cl)cc1)N(c1cc(Cl)c(=O)n(C)c1)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3653183 OBDepict CH 3 O N N O CH 3 N N H 3 C CH 3 O N CH 3 Cl Cl IC50 = 0.137 nM 538.44 COc1ncc(-c2nc3c(n2C(C)C)C(c2ccc(Cl)cc2)N(c2cc(Cl)ccc2C)C3=O)c(OC)n1 Homo sapiens CHEMBL3705464 single protein format
CHEMBL3653226 OBDepict CH 3 O N N N O H 3 C CH 3 CH 3 H 3 C O N F Cl Cl IC50 = 0.14 nM 581.48 COc1ccc(C(=O)N(C)C)cc1-c1nc2c(n1C(C)C)C(c1ccc(Cl)cc1)N(c1cccc(Cl)c1F)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3653280 OBDepict CH 3 O N N N N N H 3 C CH 3 H 3 C CH 3 O N N Cl Cl OH IC50 = 0.14 nM 554.44 COc1nc(N(C)C)ncc1-c1nc2c(n1C(C)C)C(c1ccc(Cl)cc1)N(c1cnc(O)c(Cl)c1)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3653174 OBDepict HO O N N H 3 C H 3 C CH 3 O N H 3 C CH 3 Cl Cl IC50 = 0.14 nM 550.49 COc1ccc(CO)cc1-c1nc2c(n1C(C)C)C(c1ccc(Cl)cc1C)N(c1cc(Cl)ccc1C)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3653161 OBDepict N O N N H 3 C H 3 C CH 3 O N H 3 C CH 3 Cl Cl IC50 = 0.14 nM 545.47 COc1ccc(C#N)cc1-c1nc2c(n1C(C)C)C(c1ccc(Cl)cc1C)N(c1cc(Cl)ccc1C)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3656976 OBDepict CH 3 O N N N N N H 3 C CH 3 H 3 C CH 3 O N OH N Cl Cl IC50 = 0.14 nM 554.44 COc1nc(N(C)C)ncc1-c1nc2c(n1C(C)C)C(c1ccc(Cl)cc1)N(c1cc(Cl)cnc1O)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3657121 OBDepict H 3 C O N CH 3 H N N O N O N H 3 C N N Cl Cl CH 3 H 3 C CH 3 O IC50 = 0.144 nM 598.49 COC[C@@H](C)n1c(-c2cnc(N(C)C)nc2OC)nc2c1C(c1ccc(Cl)cc1)N(c1cc(Cl)c(=O)n(C)c1)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3691722 OBDepict H 2 N N O N H 3 C H 3 C CH 3 O N H 3 C CH 3 Cl Cl IC50 = 0.146 nM 549.5 COc1ccc(CN)cc1-n1nc2c(c1C(C)C)C(c1ccc(Cl)cc1C)N(c1cc(Cl)ccc1C)C2=O Homo sapiens CHEMBL3707807 single protein format
CHEMBL3927813 OBDepict O N NH O N F O HO H H 3 C H 3 C CH 3 F F Cl Ki = 0.15 nM 495.89 CC(C)(C)NC(=O)C(c1c(C(=O)O)[nH]c2cc(Cl)ccc12)N(C=O)Cc1ccc(F)c(F)c1F Homo sapiens CHEMBL3887590 assay format
CHEMBL3653175 OBDepict HO O N N H 3 C H 3 C CH 3 O N CH 3 Cl Cl IC50 = 0.15 nM 536.46 COc1ccc(CO)cc1-c1nc2c(n1C(C)C)C(c1ccc(Cl)cc1)N(c1cc(Cl)ccc1C)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3657068 OBDepict H 3 C O N CH 3 H N N O N O N H 3 C O Cl Cl H 3 C F IC50 = 0.15 nM 572.42 COC[C@@H](C)n1c(-c2cnc(OC)nc2OC)nc2c1C(c1ccc(Cl)cc1)N(c1ccc(F)c(Cl)c1)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3657067 OBDepict H 3 C O N CH 3 H N N O N O N H 3 C F O Cl Cl H 3 C IC50 = 0.15 nM 572.42 COC[C@@H](C)n1c(-c2cnc(OC)nc2OC)nc2c1C(c1ccc(Cl)cc1)N(c1cccc(Cl)c1F)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3657023 OBDepict CH 3 O N N O CH 3 N N H 3 C CH 3 O N F Cl Cl IC50 = 0.15 nM 542.4 COc1ncc(-c2nc3c(n2C(C)C)C(c2ccc(Cl)cc2)N(c2cccc(Cl)c2F)C3=O)c(OC)n1 Homo sapiens CHEMBL3705464 single protein format
CHEMBL3318765 OBDepict CH 3 N S O O N H O H H 3 C H O OH Cl Cl CH 3 IC50 = 0.15 nM 595.59 CCN(CC)S(=O)(=O)C[C@H](C1CC1)N1C(=O)[C@@](C)(CC(=O)O)C[C@H](c2cccc(Cl)c2)[C@H]1c1ccc(Cl)cc1 Homo sapiens CHEMBL3370341 single protein format
CHEMBL3657057 OBDepict CH 3 HN N N O CH 3 N N H 3 C CH 3 O N F F Cl N IC50 = 0.15 nM 549.97 CNc1ncc(-c2nc3c(n2C(C)C)C(c2ccc(C#N)c(F)c2)N(c2cccc(Cl)c2F)C3=O)c(OC)n1 Homo sapiens CHEMBL3705464 single protein format
CHEMBL3653197 OBDepict CH 3 O N N H N N N H 3 C H 3 C H 3 C O N CH 3 Cl + N _ C IC50 = 0.15 nM 528.02 [C-]#[N+]c1ccc(C2c3c(nc(-c4cnc(NC)nc4OC)n3C(C)C)C(=O)N2c2cc(Cl)ccc2C)cc1 Homo sapiens CHEMBL3705464 single protein format
CHEMBL3657091 OBDepict CH 3 O N N N N N H 3 C CH 3 H 3 C CH 3 O N H O N F Cl CH 3 N IC50 = 0.152 nM 577.02 COc1nc(N(C)C)ncc1-c1nc2c(n1C(C)C)[C@H](c1ccc(C#N)c(F)c1)N(c1cc(Cl)cn(C)c1=O)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3691792 OBDepict CH 3 O N N N N N H 3 C CH 3 H 3 C CH 3 O N N F Cl CH 3 Cl O IC50 = 0.155 nM 586.46 COc1nc(N(C)C)ncc1-n1nc2c(c1C(C)C)C(c1ccc(Cl)c(F)c1)N(c1cc(Cl)c(=O)n(C)c1)C2=O Homo sapiens CHEMBL3707807 single protein format
CHEMBL3355430 OBDepict Cl N H O N H H H F N H O Cl O OH Ki = 0.16 nM 582.46 O=C(O)c1ccc(NC(=O)[C@@H]2NC3(CCCCC3)[C@@]3(C(=O)Nc4cc(Cl)ccc43)[C@H]2c2cccc(Cl)c2F)cc1 Homo sapiens CHEMBL3380268 single protein format
CHEMBL3656987 OBDepict N N N O N N H 3 C H 3 C CH 3 O N CH 3 Cl Cl IC50 = 0.16 nM 533.42 COc1cnc(C#N)nc1-c1nc2c(n1C(C)C)C(c1ccc(Cl)cc1)N(c1cc(Cl)ccc1C)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3653191 OBDepict CH 3 O N N N N N H 3 C CH 3 H 3 C CH 3 O N H 3 C CH 3 Cl Cl IC50 = 0.16 nM 565.51 COc1nc(N(C)C)ncc1-c1nc2c(n1C(C)C)C(c1ccc(Cl)cc1C)N(c1cc(Cl)ccc1C)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3657014 OBDepict CH 3 O N O N N N CH 3 H 3 C CH 3 O N H F Cl N IC50 = 0.16 nM 532.96 COc1ncc(-c2nc3c(n2C(C)C)[C@H](c2ccc(C#N)cc2)N(c2cccc(Cl)c2F)C3=O)c(OC)n1 Homo sapiens CHEMBL3705464 single protein format
CHEMBL3653207 OBDepict HO N H 3 C N N O H 3 C N N CH 3 H 3 C O N H 3 C H 3 C Cl Cl IC50 = 0.16 nM 595.53 COc1nc(N(C)CCO)ncc1-c1nc2c(n1C(C)C)C(c1ccc(Cl)cc1C)N(c1cc(Cl)ccc1C)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3657011 OBDepict CH 3 O N N N N N H 3 C CH 3 H 3 C CH 3 O N O N Cl CH 3 Cl IC50 = 0.16 nM 568.47 COc1nc(N(C)C)ncc1-c1nc2c(n1C(C)C)C(c1ccc(Cl)cc1)N(c1cc(Cl)cn(C)c1=O)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3653202 OBDepict CH 3 HN N N O CH 3 N N H 3 C CH 3 O N H 3 C CH 3 Cl Cl IC50 = 0.16 nM 551.48 CNc1ncc(-c2nc3c(n2C(C)C)C(c2ccc(Cl)cc2C)N(c2cc(Cl)ccc2C)C3=O)c(OC)n1 Homo sapiens CHEMBL3705464 single protein format
CHEMBL3691737 OBDepict CH 3 O N N H 3 C CH 3 O N H H 3 C CH 3 Cl Cl IC50 = 0.161 nM 520.46 COc1ccccc1-n1nc2c(c1C(C)C)[C@H](c1ccc(Cl)cc1C)N(c1cc(Cl)ccc1C)C2=O Homo sapiens CHEMBL3707807 single protein format
CHEMBL3691764 OBDepict CH 3 O N N O N CH 3 N H 3 C CH 3 O N H O N Cl H Cl IC50 = 0.161 nM 541.4 COc1ncc(-n2nc3c(c2C(C)C)[C@H](c2ccc(Cl)cc2)N(c2cc(Cl)c[nH]c2=O)C3=O)c(OC)n1 Homo sapiens CHEMBL3707807 single protein format
CHEMBL3691793 OBDepict CH 3 O N N N N N H 3 C CH 3 H 3 C CH 3 O N N F Cl H Cl O IC50 = 0.164 nM 572.43 COc1nc(N(C)C)ncc1-n1nc2c(c1C(C)C)C(c1ccc(Cl)c(F)c1)N(c1c[nH]c(=O)c(Cl)c1)C2=O Homo sapiens CHEMBL3707807 single protein format
CHEMBL3691791 OBDepict CH 3 O N N N N N H 3 C CH 3 H 3 C CH 3 O N O N F Cl H Cl IC50 = 0.165 nM 572.43 COc1nc(N(C)C)ncc1-n1nc2c(c1C(C)C)C(c1ccc(Cl)c(F)c1)N(c1cc(Cl)c[nH]c1=O)C2=O Homo sapiens CHEMBL3707807 single protein format
CHEMBL3691753 OBDepict CH 3 O N N N N N H 3 C CH 3 H 3 C CH 3 O N O N Cl H N IC50 = 0.166 nM 545.0 COc1nc(N(C)C)ncc1-n1nc2c(c1C(C)C)C(c1ccc(C#N)cc1)N(c1cc(Cl)c[nH]c1=O)C2=O Homo sapiens CHEMBL3707807 single protein format
CHEMBL3691724 OBDepict O NH N O N CH 3 H 3 C CH 3 O N H 3 C CH 3 Cl Cl IC50 = 0.169 nM 577.51 COc1ccc(CNC=O)cc1-n1nc2c(c1C(C)C)C(c1ccc(Cl)cc1C)N(c1cc(Cl)ccc1C)C2=O Homo sapiens CHEMBL3707807 single protein format
CHEMBL3923181 OBDepict O N NH O N F O HO H H 3 C H 3 C CH 3 F F Cl Ki = 0.17 nM 495.89 CC(C)(C)NC(=O)C(c1c(C(=O)O)[nH]c2cc(Cl)ccc12)N(C=O)Cc1cc(F)cc(F)c1F Homo sapiens CHEMBL3887590 assay format
CHEMBL3653307 OBDepict CH 3 O N N H 3 C CH 3 N O O N H 3 C H 3 C F Cl Cl IC50 = 0.17 nM 595.5 COc1ccc(CC(=O)N(C)C)cc1-c1nc2c(n1C(C)C)C(c1ccc(Cl)cc1)N(c1cccc(Cl)c1F)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3653306 OBDepict CH 3 N H O O N N CH 3 H 3 C CH 3 O N CH 3 Cl Cl IC50 = 0.17 nM 577.51 CNC(=O)Cc1ccc(OC)c(-c2nc3c(n2C(C)C)C(c2ccc(Cl)cc2)N(c2cc(Cl)ccc2C)C3=O)c1 Homo sapiens CHEMBL3705464 single protein format
CHEMBL3653159 OBDepict CH 3 O F N N H 3 C CH 3 O N H 3 C CH 3 Cl Cl IC50 = 0.17 nM 538.45 COc1cccc(F)c1-c1nc2c(n1C(C)C)C(c1ccc(Cl)cc1C)N(c1cc(Cl)ccc1C)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3657066 OBDepict H 3 C O N CH 3 H N N O N O N H 3 C CH 3 O Cl H 3 C N IC50 = 0.17 nM 559.03 COC[C@@H](C)n1c(-c2cnc(OC)nc2OC)nc2c1C(c1ccc(C#N)cc1)N(c1cc(Cl)ccc1C)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3653219 OBDepict NH 2 O H 3 C N N H 3 C CH 3 O N CH 3 Cl Cl IC50 = 0.17 nM 535.48 COc1cc(CN)ccc1-c1nc2c(n1C(C)C)C(c1ccc(Cl)cc1)N(c1cc(Cl)ccc1C)C2=O Homo sapiens CHEMBL3705464 single protein format
CHEMBL3653164 OBDepict CH 3 O N N O CH 3 N N H 3 C CH 3 O N H 3 C CH 3 Cl Cl IC50 = 0.17 nM 552.46 COc1ncc(-c2nc3c(n2C(C)C)C(c2ccc(Cl)cc2C)N(c2cc(Cl)ccc2C)C3=O)c(OC)n1 Homo sapiens CHEMBL3705464 single protein format
CHEMBL3653195 OBDepict OH N H N N O CH 3 N N H 3 C CH 3 O N CH 3 Cl Cl IC50 = 0.17 nM 567.48 COc1nc(NCCO)ncc1-c1nc2c(n1C(C)C)C(c1ccc(Cl)cc1)N(c1cc(Cl)ccc1C)C2=O Homo sapiens CHEMBL3705464 single protein format