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P14550 | AK1A1_HUMAN | Aldo-keto reductase family 1 member A1 (AKR1A1)

3D structures mapped by conservation among orthologs

[ Domain: "TIM barrels" // Aldo_ket_red ]

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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
CHEMBL273910 OBDepict O NH O O N O F F Br IC50 = 6.7 nM 449.21 O=C1CC2(C(=O)N1)C(=O)N(Cc1ccc(Br)cc1F)C(=O)c1ccc(F)cc12 Homo sapiens CHEMBL1174255 assay format
CHEMBL436 OBDepict CH 3 O F F F N S CH 3 O OH IC50 = 720.0 nM 357.35 COc1ccc2c(C(=S)N(C)CC(=O)O)cccc2c1C(F)(F)F Homo sapiens CHEMBL1174255 assay format