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Attributes

UniProt ID
Protein Name
Aldo-keto reductase family 1 member B1
Ligand Name
3-({[2-(carboxymethoxy)-4-fluorobenzoyl]amino}methyl)benzoic acid
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
NEABINVPHSWADT-UHFFFAOYSA-N
SMILES
c1cc(cc(c1)C(=O)O)CNC(=O)c2ccc(cc2OCC(=O)O)F
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

Interactive Mol* view for the current protein-molecule pair.

Structure: 4YS1
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Color Legend
Unassigned regionsLigand / hetero atomse4ys1A1
ECOD domains from experimental PDB structures interacting with ligand 4G7
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P15121n/a4G74ys1e4ys1A1A:0-315
P15121n/a4G76t7qe6t7qA1A:0-315
P15121n/a4G76txpe6txpA1A:0-315
P15121n/a4G76y1pe6y1pA1A:0-315
P15121n/a4G78b3ne8b3nA1A:0-315
P15121n/a4G78b66e8b66A1A:-2-315