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P38398 | BRCA1_HUMAN | Breast cancer type 1 susceptibility protein (BRCA1)

3D structures mapped by conservation among orthologs

[ Domain: "RING/U-box" // zf-C3HC4_4 ]

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[ Domain: "BRCT domain" // PTCB-BRCT ]

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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
CHEMBL1784785 OBDepict CH 3 HN O H N O O P H O OH HO N H O H NH O H 3 C H 3 C H O OH Ki = 200.0 nM 570.54 CC(=O)N[C@@H](COP(=O)(O)O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C Homo sapiens CHEMBL2019951 single protein format
CHEMBL1784784 OBDepict CH 3 NH O H N O O P H O OH HO HN O H HO CH 3 H HN O H O OH Ki = 270.0 nM 572.51 CC(=O)N[C@@H](COP(=O)(O)O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)O Homo sapiens CHEMBL2019951 single protein format
CHEMBL1784784 OBDepict CH 3 NH O H N O O P H O OH HO HN O H HO CH 3 H HN O H O OH IC50 = 1000.0 nM 572.51 CC(=O)N[C@@H](COP(=O)(O)O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)O Homo sapiens CHEMBL1785941 single protein format