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P55211 | CASP9_HUMAN | Caspase-9 (CASP9)

3D structures mapped by conservation among orthologs

[ Domain: "DEATH domain" // CARD ]

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[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

IC50 table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL23226 OBDepict F O HN O HO O HN H CH 3 H 3 C O O IC50 = 5.0 nM 382.39 CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC(CC(=O)O)C(=O)CF Homo sapiens CHEMBL659720 single protein format
CHEMBL237310 OBDepict F O N H O OH O NH O HN H CH 3 H 3 C O O IC50 = 6.0 nM 487.48 CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccccc1C(=O)NC(C(=O)O)C(=O)CF Homo sapiens CHEMBL899140 single protein format
CHEMBL185356 OBDepict F O HN O O HO HN H H 3 C H 3 C O O Cl Cl IC50 = 9.0 nM 451.28 CC(C)[C@H](NC(=O)OCc1ccc(Cl)cc1Cl)C(=O)NC(CC(=O)O)C(=O)CF Homo sapiens CHEMBL827050 single protein format
CHEMBL180263 OBDepict F O N H O O OH O H CH 3 H 3 C N H O IC50 = 30.0 nM 368.36 CC(C)[C@H](OC(=O)Nc1ccccc1)C(=O)NC(CC(=O)O)C(=O)CF Homo sapiens CHEMBL827040 single protein format
CHEMBL90224 OBDepict O N H H O O OH NH H O H 3 C CH 3 NH IC50 = 160.0 nM 413.47 CC(C)C[C@H](NC(=O)CNc1cccc2ccccc12)C(=O)N[C@H](C=O)CC(=O)O Homo sapiens CHEMBL659719 single protein format
CHEMBL90307 OBDepict O N H H O O HO HN H O H 3 C CH 3 HN O IC50 = 230.0 nM 427.46 CC(C)C[C@H](NC(=O)C(=O)Nc1cccc2ccccc12)C(=O)N[C@H](C=O)CC(=O)O Homo sapiens CHEMBL659719 single protein format