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Q13490 | BIRC2_HUMAN | Baculoviral IAP repeat-containing protein 2 (BIRC2)

3D structures mapped by conservation among orthologs

[ Domain: "RuvA-C, UBA, CRAL/TRIO-N, HBS1" // UBA_BIRC2_3 ]

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[ Domain: "DEATH domain" // CARD ]

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

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[ Domain: "Inhibitor of apoptosis (IAP) repeat" // BIR ]

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[ Domain: pdbs with more than 2 multi-domains ]

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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
CHEMBL4166057 OBDepict HO N N H 3 C CH 3 O N F H H H 3 C N H N H H 3 C H CH 3 O IC50 = 0.1 nM 553.72 C[C@@H]1CN(CC(=O)N2CC(C)(C)c3nc(CO)c(Cc4ccc(F)cc4)cc32)[C@@H](CN2[C@H](C)COC[C@H]2C)CN1 Homo sapiens CHEMBL4157561 cell-based format
CHEMBL4167141 OBDepict H N N H N H H 3 C H H 3 C H CH 3 N O O H 3 C CH 3 N H O F IC50 = 0.13 nM 539.7 C[C@@H]1CN(CC(=O)N2CC(C)(C)c3[nH]c(=O)c(Cc4ccc(F)cc4)cc32)[C@@H](CN2[C@H](C)COC[C@H]2C)CN1 Homo sapiens CHEMBL4157561 cell-based format
CHEMBL4171490 OBDepict F F N N N H 3 C H 3 C O N H H CH 3 HN N O F IC50 = 0.17 nM 578.64 C[C@@H]1CN(CC(=O)N2CC(C)(C)c3nnc(Cc4ccc(F)cc4F)cc32)[C@@H](CN2Cc3c(F)cccc3C2=O)CN1 Homo sapiens CHEMBL4157561 cell-based format
CHEMBL4169478 OBDepict H N N H N H H 3 C H H 3 C H CH 3 N O O H 3 C CH 3 N CH 3 O F IC50 = 0.18 nM 553.72 C[C@@H]1CN(CC(=O)N2CC(C)(C)c3c2cc(Cc2ccc(F)cc2)c(=O)n3C)[C@@H](CN2[C@H](C)COC[C@H]2C)CN1 Homo sapiens CHEMBL4157561 cell-based format
CHEMBL4166607 OBDepict H N N H N H H 3 C H H 3 C H CH 3 N O O H 3 C CH 3 N F IC50 = 0.19 nM 523.7 C[C@@H]1CN(CC(=O)N2CC(C)(C)c3ncc(Cc4ccc(F)cc4)cc32)[C@@H](CN2[C@H](C)COC[C@H]2C)CN1 Homo sapiens CHEMBL4157561 cell-based format
CHEMBL4164271 OBDepict F F N N N H 3 C H 3 C O N H H CH 3 HN N O F IC50 = 0.2 nM 578.64 C[C@@H]1CN(CC(=O)N2CC(C)(C)c3nnc(Cc4ccc(F)cc4F)cc32)[C@@H](CN2Cc3cc(F)ccc3C2=O)CN1 Homo sapiens CHEMBL4157561 cell-based format
CHEMBL4173974 OBDepict HO N N H 3 C CH 3 O N F H H H 3 C N H N H CH 3 O IC50 = 0.22 nM 539.7 C[C@@H]1CN(CC(=O)N2CC(C)(C)c3nc(CO)c(Cc4ccc(F)cc4)cc32)[C@@H](CN2CCOC[C@H]2C)CN1 Homo sapiens CHEMBL4157561 cell-based format
CHEMBL4064619 OBDepict F N N CH 3 H 3 C O N H H CH 3 N H N H H 3 C O IC50 = 0.32 nM 509.67 C[C@@H]1CN(CC(=O)N2CC(C)(C)c3ncc(Cc4ccc(F)cc4)cc32)[C@@H](CN2CCOC[C@H]2C)CN1 Homo sapiens CHEMBL4157561 cell-based format
CHEMBL234346 OBDepict CH 3 CH 3 H N H H O HO O H N O NH H CH 3 CH 3 O H 2 N H 3 C H IC50 = 0.32 nM 398.5 CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)N)C(C)C)C(=O)O Homo sapiens CHEMBL4015839 single protein format
CHEMBL4160872 OBDepict F F N N N H 3 C H 3 C O N H H CH 3 HN N O IC50 = 0.34 nM 560.65 C[C@@H]1CN(CC(=O)N2CC(C)(C)c3nnc(Cc4ccc(F)cc4F)cc32)[C@@H](CN2Cc3ccccc3C2=O)CN1 Homo sapiens CHEMBL4157561 cell-based format
CHEMBL475670 OBDepict H 3 C N H CH 3 H HN O H O N H H H N H O H Ki = 0.37 nM 530.71 CN[C@@H](C)C(=O)N[C@H]1CCCC[C@H]2[C@@H](Cc3ccccc3)C[C@@H](C(=O)N[C@@H]3CCCc4ccccc43)N2C1=O Homo sapiens CHEMBL985935 cell-based format
CHEMBL4159232 OBDepict F OH N N CH 3 H 3 C O N H H CH 3 N H N H CH 3 H H 3 C O IC50 = 0.59 nM 539.7 C[C@@H]1CN(CC(=O)N2CC(C)(C)c3ncc(Cc4ccc(F)cc4O)cc32)[C@@H](CN2[C@H](C)COC[C@H]2C)CN1 Homo sapiens CHEMBL4157561 cell-based format
CHEMBL4168197 OBDepict H N N H N H CH 3 H H 3 C H H 3 C N O O H 3 C CH 3 N F IC50 = 0.62 nM 523.7 C[C@H]1COC[C@@H](C)N1C[C@H]1CN[C@H](C)CN1CC(=O)N1CC(C)(C)c2ncc(Cc3ccc(F)cc3)cc21 Homo sapiens CHEMBL4157561 cell-based format
CHEMBL481213 OBDepict H 3 C HN CH 3 H HN O H O N H H N H O H Ki = 0.68 nM 440.59 CN[C@@H](C)C(=O)N[C@H]1CCCC[C@H]2CC[C@@H](C(=O)N[C@@H]3CCCc4ccccc43)N2C1=O Homo sapiens CHEMBL985935 cell-based format
CHEMBL4177336 OBDepict H N N H N H CH 3 H CH 3 H H 3 C N O O CH 3 H 3 C N O F IC50 = 0.7 nM 539.7 C[C@@H]1CN(CC(=O)N2CC(C)(C)c3cc(=O)n(Cc4ccc(F)cc4)cc32)[C@@H](CN2[C@H](C)COC[C@H]2C)CN1 Homo sapiens CHEMBL4157561 cell-based format
CHEMBL4174922 OBDepict F F N N N H 3 C H 3 C O N H H CH 3 HN N O F IC50 = 0.74 nM 578.64 C[C@@H]1CN(CC(=O)N2CC(C)(C)c3nnc(Cc4ccc(F)cc4F)cc32)[C@@H](CN2Cc3ccc(F)cc3C2=O)CN1 Homo sapiens CHEMBL4157561 cell-based format
CHEMBL481422 OBDepict H 3 C N H CH 3 H HN O H O N H H N H O Ki = 0.8 nM 476.62 CN[C@@H](C)C(=O)N[C@H]1CCCC[C@H]2CC[C@@H](C(=O)NC(c3ccccc3)c3ccccc3)N2C1=O Homo sapiens CHEMBL985935 cell-based format
CHEMBL4114897 OBDepict CH 3 HN CH 3 H HN O N N N N H 3 C N CH 3 CH 3 N IC50 = 1.0 nM 490.57 CN[C@H](C)C(=O)Nc1cc(-c2ncnc3c(C)nn(C)c23)cc(C#Cc2ccc3c(C)nccc3c2)n1 Homo sapiens CHEMBL3888131 single protein format
CHEMBL3915777 OBDepict H 3 C NH H 3 C NH O N NH N O N N N N CH 3 CH 3 Cl IC50 = 1.0 nM 479.93 CNC(C)C(=O)Nc1cc(-c2ncnc3nc(C)n(C)c23)cc(NC(=O)c2ccc(Cl)cn2)n1 Homo sapiens CHEMBL3887924 single protein format
CHEMBL3963948 OBDepict CH 3 HN CH 3 HN O N N N N CH 3 N H 3 C F N IC50 = 1.0 nM 494.53 CNC(C)C(=O)Nc1cc(-c2ncnc3c(C)nn(C)c23)cc(C#Cc2cc(F)c3ncccc3c2)n1 Homo sapiens CHEMBL3888131 single protein format
CHEMBL3953439 OBDepict CH 3 HN CH 3 HN O N N H N O N N CH 3 N H 3 C N F CH 3 Cl IC50 = 1.0 nM 511.95 CNC(C)C(=O)Nc1cc(-c2nc(C)nc3c(C)nn(C)c23)cc(NC(=O)c2ncc(Cl)cc2F)n1 Homo sapiens CHEMBL3887924 single protein format
CHEMBL3944851 OBDepict CH 3 NH H 3 C NH O N N H N O N N N CH 3 N H 3 C H 3 C Cl IC50 = 1.0 nM 493.96 CNC(C)C(=O)Nc1cc(-c2ncnc3c(C)nn(C)c23)cc(NC(=O)c2ncc(Cl)cc2C)n1 Homo sapiens CHEMBL3887924 single protein format
CHEMBL3937672 OBDepict H 3 C NH H 3 C NH O N NH O N N N CH 3 Cl IC50 = 1.0 nM 463.93 CNC(C)C(=O)Nc1cc(-c2cncc3ccn(C)c23)cc(NC(=O)c2ccc(Cl)cn2)n1 Homo sapiens CHEMBL3887924 single protein format
CHEMBL3896543 OBDepict CH 3 HN CH 3 H HN O N N N N H 3 C CH 3 CH 3 N IC50 = 1.0 nM 565.68 CN[C@@H](C)C(=O)Nc1ccc(-c2c(-c3ccc(C)nc3)nc3cc(C)ccn23)c(C#Cc2ccc3c(C)nccc3c2)n1 Homo sapiens CHEMBL3889229 single protein format
CHEMBL3935909 OBDepict CH 3 N H CH 3 NH O N HN N O N N CH 3 N CH 3 H 3 C H 3 C Cl IC50 = 1.0 nM 507.0 CNC(C)C(=O)Nc1cc(-c2nc(C)nc3c(C)c(C)n(C)c23)cc(NC(=O)c2ccc(Cl)cn2)n1 Homo sapiens CHEMBL3887924 single protein format
CHEMBL3898413 OBDepict CH 3 HN CH 3 HN O N N N N CH 3 N N H 3 C N N CH 3 IC50 = 1.0 nM 480.54 CNC(C)C(=O)Nc1cc(-c2ncnc3c(C)nn(C)c23)cc(C#Cc2cnc3c(cnn3C)c2)n1 Homo sapiens CHEMBL3888131 single protein format
CHEMBL3967322 OBDepict CH 3 N H CH 3 NH O N HN O N CH 3 N Cl IC50 = 1.0 nM 474.95 CNC(C)C(=O)Nc1cc(-c2cccc3cncc(C)c23)cc(NC(=O)c2ccc(Cl)cn2)n1 Homo sapiens CHEMBL3887924 single protein format
CHEMBL3905467 OBDepict CH 3 HN CH 3 H HN O N N N N N CH 3 H 3 C CH 3 N IC50 = 1.0 nM 554.66 CN[C@@H](C)C(=O)Nc1ccc(-c2c(-c3cncn3C)nc3cc(C)ccn23)c(C#Cc2ccc3c(C)nccc3c2)n1 Homo sapiens CHEMBL3889229 single protein format
CHEMBL3895473 OBDepict CH 3 O N N N N H 3 C NH O NH H 3 C H H 3 C H 3 C N IC50 = 1.0 nM 581.68 CN[C@@H](C)C(=O)Nc1ccc(-c2c(-c3cccnc3OC)nc3cc(C)ccn23)c(C#Cc2ccc3c(C)nccc3c2)n1 Homo sapiens CHEMBL3889229 single protein format
CHEMBL3981054 OBDepict H 3 C NH H 3 C H NH O N N N N N H 3 C CH 3 CH 3 N IC50 = 1.0 nM 554.66 CN[C@@H](C)C(=O)Nc1ccc(-c2c(-c3cnn(C)c3)nc3cc(C)ccn23)c(C#Cc2ccc3c(C)nccc3c2)n1 Homo sapiens CHEMBL3889229 single protein format
CHEMBL3911035 OBDepict H 3 C NH H 3 C H NH O N N N N H 3 C CH 3 CH 3 N IC50 = 1.0 nM 565.68 CN[C@@H](C)C(=O)Nc1ccc(-c2c(-c3ccnc(C)c3)nc3cc(C)ccn23)c(C#Cc2ccc3c(C)nccc3c2)n1 Homo sapiens CHEMBL3889229 single protein format
CHEMBL3930510 OBDepict CH 3 O N N N N H 3 C NH O NH H 3 C H H 3 C N H 3 C O IC50 = 1.0 nM 597.68 CN[C@@H](C)C(=O)Nc1ccc(-c2c(-c3cccnc3OC)nc3cc(C)ccn23)c(C#Cc2ccc3c(ccc(=O)n3C)c2)n1 Homo sapiens CHEMBL3889229 single protein format
CHEMBL3923211 OBDepict CH 3 HN CH 3 HN O N HN N O N N H 3 C H 3 C O IC50 = 1.0 nM 485.55 CNC(C)C(=O)Nc1cc(-c2cccc3nc(C)c(C)n23)cc(NC(=O)c2cc3c(cn2)COC3)n1 Homo sapiens CHEMBL3887924 single protein format
CHEMBL4115526 OBDepict CH 3 HN CH 3 H HN O N N N N H 3 C N CH 3 CH 3 N F IC50 = 1.0 nM 508.56 CN[C@H](C)C(=O)Nc1cc(-c2ncnc3c(C)nn(C)c23)cc(C#Cc2cc(C)nc3c(F)cccc23)n1 Homo sapiens CHEMBL3888131 single protein format
CHEMBL3928237 OBDepict H 3 C N H CH 3 NH O N HN N O N N Cl Cl IC50 = 1.0 nM 484.35 CNC(C)C(=O)Nc1cc(-c2cnc3cccc(Cl)n23)cc(NC(=O)c2ccc(Cl)cn2)n1 Homo sapiens CHEMBL3887924 single protein format
CHEMBL3929287 OBDepict CH 3 N H CH 3 NH O N HN N O N N CH 3 N CH 3 N H 3 C Cl IC50 = 1.0 nM 493.96 CNC(C)C(=O)Nc1cc(-c2nc(C)nc3c(C)nn(C)c23)cc(NC(=O)c2ccc(Cl)cn2)n1 Homo sapiens CHEMBL3887924 single protein format
CHEMBL3946504 OBDepict CH 3 N H CH 3 NH O N HN N O N N F Cl IC50 = 1.0 nM 479.9 CNC(C)C(=O)Nc1cc(-c2ncnc3cccc(F)c23)cc(NC(=O)c2ccc(Cl)cn2)n1 Homo sapiens CHEMBL3887924 single protein format
CHEMBL3906797 OBDepict CH 3 N H CH 3 NH O N HN N O N N Cl Cl IC50 = 1.0 nM 496.36 CNC(C)C(=O)Nc1cc(-c2ncnc3cccc(Cl)c23)cc(NC(=O)c2ccc(Cl)cn2)n1 Homo sapiens CHEMBL3887924 single protein format
CHEMBL3958007 OBDepict H 3 C NH H 3 C H NH O N N N N H 3 C CH 3 IC50 = 1.0 nM 500.61 CN[C@@H](C)C(=O)Nc1ccc(-c2c(-c3ccnc(C)c3)nc3cc(C)ccn23)c(C#Cc2ccccc2)n1 Homo sapiens CHEMBL3889229 single protein format
CHEMBL3932853 OBDepict H 3 C NH H 3 C NH O N NH N O N N CH 3 CH 3 Cl IC50 = 1.0 nM 477.96 CNC(C)C(=O)Nc1cc(-c2cccc3nc(C)c(C)n23)cc(NC(=O)c2ccc(Cl)cn2)n1 Homo sapiens CHEMBL3887924 single protein format
CHEMBL3946388 OBDepict CH 3 HN CH 3 HN O N HN N O N N H 3 C H 3 C O CH 3 IC50 = 1.0 nM 473.54 CNC(C)C(=O)Nc1cc(-c2cccc3nc(C)c(C)n23)cc(NC(=O)c2ccc(OC)cn2)n1 Homo sapiens CHEMBL3887924 single protein format
CHEMBL3923542 OBDepict CH 3 N H CH 3 NH O N HN O O N CH 3 CH 3 N Cl IC50 = 1.0 nM 504.98 CNC(C)C(=O)Nc1cc(-c2c(OC)ccc3nccc(C)c23)cc(NC(=O)c2ccc(Cl)cn2)n1 Homo sapiens CHEMBL3887924 single protein format
CHEMBL3975889 OBDepict CH 3 N H CH 3 NH O N HN N O N CH 3 Cl IC50 = 1.0 nM 474.95 CNC(C)C(=O)Nc1cc(-c2nccc3cccc(C)c23)cc(NC(=O)c2ccc(Cl)cn2)n1 Homo sapiens CHEMBL3887924 single protein format
CHEMBL1241426 OBDepict H 3 C HN CH 3 H HN O H O N H N H H H N H O O H Ki < 1.0 nM 573.74 CN[C@@H](C)C(=O)N[C@H]1CC[C@@H](NC(=O)Cc2ccccc2)C[C@H]2CC[C@@H](C(=O)N[C@@H]3CCCc4ccccc43)N2C1=O Homo sapiens CHEMBL1248007 cell-based format
CHEMBL3935993 OBDepict CH 3 N H CH 3 NH O N HN N O N N N CH 3 N H 3 C Cl IC50 = 1.0 nM 479.93 CNC(C)C(=O)Nc1cc(-c2ncnc3c(C)nn(C)c23)cc(NC(=O)c2ccc(Cl)cn2)n1 Homo sapiens CHEMBL3887924 single protein format
CHEMBL3909016 OBDepict CH 3 HN CH 3 HN O N N N N H 3 C N CH 3 N H 3 C IC50 = 1.0 nM 490.57 CNC(C)C(=O)Nc1cc(-c2ncnc3c(C)nn(C)c23)cc(C#Cc2ccc3nc(C)ccc3c2)n1 Homo sapiens CHEMBL3888131 single protein format
CHEMBL3935487 OBDepict CH 3 HN CH 3 HN O N N N N CH 3 N H 3 C CH 3 N CH 3 IC50 = 1.0 nM 454.54 CNC(C)C(=O)Nc1cc(-c2ncnc3c(C)nn(C)c23)cc(C#Cc2cc(C)nc(C)c2)n1 Homo sapiens CHEMBL3888131 single protein format
CHEMBL3917949 OBDepict CH 3 HN CH 3 HN O N N N N CH 3 N H 3 C F F IC50 = 1.0 nM 461.48 CNC(C)C(=O)Nc1cc(-c2ncnc3c(C)nn(C)c23)cc(C#Cc2cc(F)cc(F)c2)n1 Homo sapiens CHEMBL3888131 single protein format
CHEMBL3926762 OBDepict H 3 C NH H 3 C NH O N N N N CH 3 N H 3 C N N CH 3 IC50 = 1.0 nM 505.59 CNC(C)C(=O)Nc1cc(-c2ncnc3c(C)nn(C)c23)cc(C#Cc2ccc(-n3cnc(C)c3)cc2)n1 Homo sapiens CHEMBL3888131 single protein format
CHEMBL3975877 OBDepict H 3 C N H CH 3 HN O N NH O H 3 C N N N H 3 C N CH 3 CH 3 O Cl IC50 = 1.0 nM 523.0 CNC(C)C(=O)Nc1cc(-c2c(C)nc(C)c3c(=O)n(C)n(C)c23)cc(NC(=O)c2ccc(Cl)cn2)n1 Homo sapiens CHEMBL3887924 single protein format
CHEMBL4115207 OBDepict CH 3 HN CH 3 H HN O N N N N CH 3 N H 3 C N N CH 3 IC50 = 1.0 nM 479.55 CN[C@H](C)C(=O)Nc1cc(-c2ncnc3c(C)nn(C)c23)cc(C#Cc2ccn3c(C)ncc3c2)n1 Homo sapiens CHEMBL3888131 single protein format
CHEMBL4115565 OBDepict CH 3 HN CH 3 H HN O N N N N CH 3 N H 3 C N N CH 3 IC50 = 1.0 nM 479.55 CN[C@H](C)C(=O)Nc1cc(-c2ncnc3c(C)nn(C)c23)cc(C#Cc2ccc3c(cnn3C)c2)n1 Homo sapiens CHEMBL3888131 single protein format
CHEMBL4106485 OBDepict H 3 C NH H 3 C H NH O N N N N CH 3 N CH 3 N IC50 = 1.0 nM 476.54 CN[C@H](C)C(=O)Nc1cc(-c2ncnc3cnn(C)c23)cc(C#Cc2ccc3c(C)nccc3c2)n1 Homo sapiens CHEMBL3888131 single protein format
CHEMBL3969059 OBDepict CH 3 HN CH 3 H HN O N N N N O H 3 C N CH 3 CH 3 O IC50 = 1.0 nM 597.68 CN[C@@H](C)C(=O)Nc1ccc(-c2c(-c3ccnc(OC)c3)nc3cc(C)ccn23)c(C#Cc2ccc3c(ccc(=O)n3C)c2)n1 Homo sapiens CHEMBL3889229 single protein format
CHEMBL3929505 OBDepict CH 3 HN CH 3 H HN O N N N N H 3 C N O CH 3 CH 3 O IC50 = 1.0 nM 597.68 CN[C@@H](C)C(=O)Nc1ccc(-c2c(-c3ccc(OC)nc3)nc3cc(C)ccn23)c(C#Cc2ccc3c(ccc(=O)n3C)c2)n1 Homo sapiens CHEMBL3889229 single protein format
CHEMBL4110057 OBDepict H 3 C NH H 3 C H NH O N N S H 3 C N N CH 3 N CH 3 IC50 = 1.0 nM 445.55 CN[C@H](C)C(=O)Nc1cc(-c2nc(C)nc3nn(C)c(C)c23)cc(C#Cc2cccs2)n1 Homo sapiens CHEMBL3888131 single protein format
CHEMBL4110268 OBDepict H 3 C NH H 3 C H NH O N N H 3 C N N CH 3 N N N CH 3 N N CH 3 IC50 = 1.0 nM 521.59 CN[C@H](C)C(=O)Nc1cc(-c2nc(C)nc3nn(C)c(C)c23)cc(C#Cc2cnc(-n3cnc(C)c3)nc2)n1 Homo sapiens CHEMBL3888131 single protein format
CHEMBL4107425 OBDepict H 3 C NH H 3 C H NH O N N H 3 C N N CH 3 N CH 3 N N CH 3 IC50 = 1.0 nM 493.58 CN[C@H](C)C(=O)Nc1cc(-c2nc(C)nc3nn(C)c(C)c23)cc(C#Cc2ccc3c(cnn3C)c2)n1 Homo sapiens CHEMBL3888131 single protein format
CHEMBL4167717 OBDepict N N O H N N H H H 3 C N O H 3 C CH 3 N N F F IC50 = 1.0 nM 585.66 C[C@@H]1CN(CC(=O)N2CC(C)(C)c3nnc(Cc4ccc(F)cc4F)cc32)[C@@H](CN2Cc3cc(C#N)ccc3C2=O)CN1 Homo sapiens CHEMBL4157561 cell-based format
CHEMBL4113127 OBDepict CH 3 HN CH 3 H HN O N N CH 3 N N H 3 C N H 3 C CH 3 N IC50 = 1.0 nM 504.6 CN[C@H](C)C(=O)Nc1cc(-c2nc(C)nc3nn(C)c(C)c23)cc(C#Cc2ccc3c(C)nccc3c2)n1 Homo sapiens CHEMBL3888131 single protein format
CHEMBL3964219 OBDepict CH 3 O N N N N H 3 C NH O NH H 3 C H H 3 C H 3 C N IC50 = 1.0 nM 581.68 CN[C@@H](C)C(=O)Nc1ccc(-c2c(-c3ccc(OC)nc3)nc3cc(C)ccn23)c(C#Cc2ccc3c(C)nccc3c2)n1 Homo sapiens CHEMBL3889229 single protein format
CHEMBL4108709 OBDepict CH 3 HN CH 3 H HN O N N N H 3 C N CH 3 N H 3 C N N CH 3 IC50 = 1.0 nM 493.58 CN[C@H](C)C(=O)Nc1cc(-c2nc(C)nc3c(C)nn(C)c23)cc(C#Cc2ccc3c(cnn3C)c2)n1 Homo sapiens CHEMBL3888131 single protein format
CHEMBL4110049 OBDepict CH 3 HN CH 3 H HN O N N N H 3 C N CH 3 N H 3 C CH 3 N IC50 = 1.0 nM 504.6 CN[C@H](C)C(=O)Nc1cc(-c2nc(C)nc3c(C)nn(C)c23)cc(C#Cc2ccc3c(C)nccc3c2)n1 Homo sapiens CHEMBL3888131 single protein format
CHEMBL4115053 OBDepict CH 3 HN CH 3 H HN O N N N CH 3 N H 3 C N CH 3 N CH 3 O IC50 = 1.0 nM 520.6 CN[C@H](C)C(=O)Nc1cc(-c2nc(C)nc3c(C)nn(C)c23)cc(C#Cc2ccc3c(ccc(=O)n3C)c2)n1 Homo sapiens CHEMBL3888131 single protein format
CHEMBL4110909 OBDepict CH 3 HN CH 3 H HN O N CH 3 N N CH 3 N H 3 C O CH 3 CH 3 N IC50 = 1.0 nM 533.64 CN[C@H](C)C(=O)Nc1cc(-c2c(C)nc(C)c3c(=O)n(C)n(C)c23)cc(C#Cc2ccc3c(C)nccc3c2)n1 Homo sapiens CHEMBL3888131 single protein format
CHEMBL3916269 OBDepict H 3 C NH H 3 C NH O N NH N O N N O CH 3 CH 3 Cl IC50 = 1.0 nM 479.93 CNC(C)C(=O)Nc1cc(-c2ncnc3oc(C)c(C)c23)cc(NC(=O)c2ccc(Cl)cn2)n1 Homo sapiens CHEMBL3887924 single protein format
CHEMBL4108098 OBDepict H 3 C NH H 3 C H NH O N N N N CH 3 N N CH 3 O IC50 = 1.0 nM 492.54 CN[C@H](C)C(=O)Nc1cc(-c2ncnc3cnn(C)c23)cc(C#Cc2ccc3c(ccc(=O)n3C)c2)n1 Homo sapiens CHEMBL3888131 single protein format
CHEMBL4108099 OBDepict H 3 C NH H 3 C H NH O N N N CH 3 CH 3 N IC50 = 1.0 nM 474.57 CN[C@H](C)C(=O)Nc1cc(-c2cnc3cccc(C)n23)cc(C#Cc2ccc3c(C)nccc3c2)n1 Homo sapiens CHEMBL3888131 single protein format
CHEMBL3928571 OBDepict CH 3 HN CH 3 H HN O N N N N O H 3 C CH 3 CH 3 N IC50 = 1.0 nM 581.68 CN[C@@H](C)C(=O)Nc1ccc(-c2c(-c3ccnc(OC)c3)nc3cc(C)ccn23)c(C#Cc2ccc3c(C)nccc3c2)n1 Homo sapiens CHEMBL3889229 single protein format
CHEMBL3967713 OBDepict CH 3 HN CH 3 H HN O N N N N N H 3 C CH 3 CH 3 N IC50 = 1.0 nM 566.67 CN[C@@H](C)C(=O)Nc1ccc(-c2c(-c3cnc(C)nc3)nc3cc(C)ccn23)c(C#Cc2ccc3c(C)nccc3c2)n1 Homo sapiens CHEMBL3889229 single protein format
CHEMBL4115218 OBDepict H 3 C NH H 3 C H NH O N N N CH 3 CH 3 CH 3 N IC50 = 1.0 nM 488.6 CN[C@H](C)C(=O)Nc1cc(-c2cccc3nc(C)c(C)n23)cc(C#Cc2ccc3c(C)nccc3c2)n1 Homo sapiens CHEMBL3888131 single protein format
CHEMBL516172 OBDepict H 3 C NH CH 3 H HN O H O N H H N H O H Ki = 1.1 nM 474.61 CN[C@@H](C)C(=O)N[C@H]1Cc2ccccc2[C@H]2CC[C@@H](C(=O)N[C@@H]3CCCc4ccccc43)N2C1=O Homo sapiens CHEMBL999327 assay format
CHEMBL459541 OBDepict H 3 C N H CH 3 H HN O H N H O N H H N H O Ki = 1.2 nM 477.61 CN[C@@H](C)C(=O)N[C@H]1CNCC[C@H]2CC[C@@H](C(=O)NC(c3ccccc3)c3ccccc3)N2C1=O Homo sapiens CHEMBL1025777 cell-based format
CHEMBL3094407 OBDepict CH 3 N H H NH O CH 3 H N O H H N N H O H O IC50 = 1.2 nM 539.72 CC[C@H](NC)C(=O)N[C@H](C(=O)N1C[C@H]2CCCN2C[C@H]1C(=O)N[C@@H]1CCOc2ccccc21)C1CCCCC1 Homo sapiens CHEMBL3097971 single protein format
CHEMBL472832 OBDepict H 3 C N H CH 3 H HN O H O N H H H N H O H Ki = 1.27 nM 528.7 CN[C@@H](C)C(=O)N[C@H]1C/C=CC[C@H]2[C@@H](Cc3ccccc3)C[C@@H](C(=O)N[C@@H]3CCCc4ccccc43)N2C1=O Homo sapiens CHEMBL985935 cell-based format
CHEMBL4175992 OBDepict F N N H 3 C H 3 C O N H H CH 3 HN N O IC50 = 1.3 nM 541.67 C[C@@H]1CN(CC(=O)N2CC(C)(C)c3ncc(Cc4ccc(F)cc4)cc32)[C@@H](CN2Cc3ccccc3C2=O)CN1 Homo sapiens CHEMBL4157561 cell-based format
CHEMBL456400 OBDepict CH 3 N H H 3 C H NH O H N O N O CH 3 H H N H O Ki = 1.3 nM 519.65 CN[C@@H](C)C(=O)N[C@H]1CN(C(C)=O)CC[C@H]2CC[C@@H](C(=O)NC(c3ccccc3)c3ccccc3)N2C1=O Homo sapiens CHEMBL1025777 cell-based format
CHEMBL514738 OBDepict CH 3 NH H NH O H 3 C H O N H H N O Ki = 1.3 nM 462.59 CC[C@H](NC)C(=O)N[C@H]1CCC[C@H]2CC[C@@H](C(=O)N(c3ccccc3)c3ccccc3)N2C1=O Homo sapiens CHEMBL999327 assay format
CHEMBL3094408 OBDepict CH 3 HN H N H O CH 3 H N O H H N HN O H O IC50 = 1.4 nM 587.77 CC[C@H](NC)C(=O)N[C@H](C(=O)N1C[C@@H]2Cc3ccccc3N2C[C@H]1C(=O)N[C@@H]1CCOc2ccccc21)C1CCCCC1 Homo sapiens CHEMBL3097971 single protein format
CHEMBL504559 OBDepict H 3 C N H CH 3 H HN O H N O N O H H N H O Ki = 1.5 nM 595.74 CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)Cc2ccccc2)CC[C@H]2CC[C@@H](C(=O)NC(c3ccccc3)c3ccccc3)N2C1=O Homo sapiens CHEMBL1025777 cell-based format
CHEMBL4159806 OBDepict N O N H N N H H H 3 C N O H 3 C CH 3 N N F F IC50 = 1.6 nM 585.66 C[C@@H]1CN(CC(=O)N2CC(C)(C)c3nnc(Cc4ccc(F)cc4F)cc32)[C@@H](CN2Cc3ccc(C#N)cc3C2=O)CN1 Homo sapiens CHEMBL4157561 cell-based format
CHEMBL3094409 OBDepict CH 3 HN H N H O CH 3 H N O H H N HN O H O IC50 = 1.7 nM 587.77 CC[C@H](NC)C(=O)N[C@H](C(=O)N1C[C@H]2Cc3ccccc3N2C[C@H]1C(=O)N[C@@H]1CCOc2ccccc21)C1CCCCC1 Homo sapiens CHEMBL3097971 single protein format
CHEMBL2158051 OBDepict H 3 C N H CH 3 H HN O H N O N O H H N H O CH 3 H 3 C Ki = 1.9 nM 561.73 CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)CC(C)C)CC[C@H]2CC[C@@H](C(=O)NC(c3ccccc3)c3ccccc3)N2C1=O Homo sapiens CHEMBL2162884 assay format
CHEMBL4107814 OBDepict H 3 C NH H 3 C H NH O N N H 3 C N N CH 3 N CH 3 N CH 3 O IC50 = 2.0 nM 520.6 CN[C@H](C)C(=O)Nc1cc(-c2nc(C)nc3nn(C)c(C)c23)cc(C#Cc2ccc3c(ccc(=O)n3C)c2)n1 Homo sapiens CHEMBL3888131 single protein format
CHEMBL4112542 OBDepict CH 3 HN CH 3 H HN O N N N O H 3 C H 3 C IC50 = 2.0 nM 425.49 CN[C@H](C)C(=O)Nc1cc(-c2ncnc3oc(C)c(C)c23)cc(C#Cc2ccccc2)n1 Homo sapiens CHEMBL3888131 single protein format
CHEMBL3956933 OBDepict CH 3 O N N N N NH O NH H 3 C H H 3 C H 3 C N IC50 = 2.0 nM 567.65 CN[C@@H](C)C(=O)Nc1ccc(-c2c(-c3cccnc3OC)nc3ccccn23)c(C#Cc2ccc3c(C)nccc3c2)n1 Homo sapiens CHEMBL3889229 single protein format
CHEMBL4115656 OBDepict H 3 C NH H 3 C H NH O N N N N CH 3 N N N CH 3 IC50 = 2.0 nM 491.56 CN[C@H](C)C(=O)Nc1cc(-c2ncnc3cnn(C)c23)cc(C#Cc2ccc(-n3cnc(C)c3)cc2)n1 Homo sapiens CHEMBL3888131 single protein format
CHEMBL3935923 OBDepict CH 3 HN CH 3 H HN O N N N N N H 3 C N CH 3 CH 3 O IC50 = 2.0 nM 582.67 CN[C@@H](C)C(=O)Nc1ccc(-c2c(-c3cnc(C)nc3)nc3cc(C)ccn23)c(C#Cc2ccc3c(ccc(=O)n3C)c2)n1 Homo sapiens CHEMBL3889229 single protein format
CHEMBL3898998 OBDepict CH 3 HN CH 3 HN O N HN N O N N N H 3 C N CH 3 O IC50 = 2.0 nM 487.52 CNC(C)C(=O)Nc1cc(-c2ncnc3c(C)nn(C)c23)cc(NC(=O)c2cc3c(cn2)COC3)n1 Homo sapiens CHEMBL3887924 single protein format
CHEMBL3973040 OBDepict CH 3 HN CH 3 H HN O N N N H 3 C N H 3 C CH 3 N IC50 = 2.0 nM 565.68 CN[C@@H](C)C(=O)Nc1ccc(-c2c(-c3cccnc3C)nc3cc(C)ccn23)c(C#Cc2ccc3c(C)nccc3c2)n1 Homo sapiens CHEMBL3889229 single protein format
CHEMBL3932969 OBDepict CH 3 N H CH 3 HN O N NH O N H 3 C N N CH 3 Cl IC50 = 2.0 nM 477.96 CNC(C)C(=O)Nc1cc(-c2cccc3c2c(C)nn3C)cc(NC(=O)c2ccc(Cl)cn2)n1 Homo sapiens CHEMBL3887924 single protein format
CHEMBL4107160 OBDepict H 3 C NH H 3 C H NH O N N N N CH 3 N IC50 = 2.0 nM 411.47 CN[C@H](C)C(=O)Nc1cc(-c2ncnc3cnn(C)c23)cc(C#Cc2ccccc2)n1 Homo sapiens CHEMBL3888131 single protein format
CHEMBL3142652 OBDepict CH 3 HN CH 3 H HN O H N O H H N N H O H O ClH ClH IC50 = 2.1 nM 598.62 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H]2CCCN2C[C@H]1C(=O)N[C@@H]1CCOc2ccccc21)C1CCCCC1.Cl.Cl Homo sapiens CHEMBL2421322 single protein format
CHEMBL2365533 OBDepict CH 3 HN CH 3 H HN O H N O H H N N H O H O IC50 = 2.1 nM 525.69 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H]2CCCN2C[C@H]1C(=O)N[C@@H]1CCOc2ccccc21)C1CCCCC1 Homo sapiens CHEMBL3097971 single protein format
CHEMBL3094406 OBDepict CH 3 HN CH 3 H HN O H N O H H N N H O H O IC50 = 2.2 nM 525.69 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@@H]2CCCN2C[C@H]1C(=O)N[C@@H]1CCOc2ccccc21)C1CCCCC1 Homo sapiens CHEMBL3097971 single protein format
CHEMBL4162607 OBDepict F HO H N N H 3 C CH 3 O N H H H 3 C N H N H H 3 C H CH 3 O IC50 = 2.3 nM 539.7 C[C@@H]1CN(CC(=O)N2CC(C)(C)c3ncc([C@H](O)c4ccc(F)cc4)cc32)[C@@H](CN2[C@H](C)COC[C@H]2C)CN1 Homo sapiens CHEMBL4157561 cell-based format
CHEMBL4168144 OBDepict F N N N H 3 C H 3 C O N H H CH 3 HN N O IC50 = 2.5 nM 542.66 C[C@@H]1CN(CC(=O)N2CC(C)(C)c3nnc(Cc4ccc(F)cc4)cc32)[C@@H](CN2Cc3ccccc3C2=O)CN1 Homo sapiens CHEMBL4157561 cell-based format
CHEMBL1241426 OBDepict H 3 C HN CH 3 H HN O H O N H N H H H N H O O H IC50 = 2.6 nM 573.74 CN[C@@H](C)C(=O)N[C@H]1CC[C@@H](NC(=O)Cc2ccccc2)C[C@H]2CC[C@@H](C(=O)N[C@@H]3CCCc4ccccc43)N2C1=O Homo sapiens CHEMBL1248007 cell-based format
CHEMBL3091493 OBDepict H 3 C HN CH 3 H HN O H N O H H N N H O H O IC50 = 2.8 nM 573.74 CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H]2Cc3ccccc3N2C[C@H]1C(=O)N[C@@H]1CCOc2ccccc21)C1CCCCC1 Homo sapiens CHEMBL3097971 single protein format
CHEMBL515347 OBDepict H 3 C NH CH 3 H HN O H O N H H N H O Ki = 3.0 nM 510.64 CN[C@@H](C)C(=O)N[C@H]1Cc2ccccc2[C@H]2CC[C@@H](C(=O)NC(c3ccccc3)c3ccccc3)N2C1=O Homo sapiens CHEMBL999327 assay format