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Attributes

UniProt ID
Protein Name
Bile acid receptor
Ligand Name
2-[benzyl(methyl)amino]ethyl methyl 2,6-dimethyl-4-(3-nitrophenyl)pyridine-3,5-dicarboxylate
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
GROZWIBBDLLXKU-UHFFFAOYSA-N
SMILES
Cc1c(c(c(c(n1)C)C(=O)OCCN(C)Cc2ccccc2)c3cccc(c3)[N+](=O)[O-])C(=O)OC
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 5YXJ
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Color Legend
Unassigned regionsLigand / hetero atomse5yxjA1e5yxjB1
ECOD domains from experimental PDB structures interacting with ligand 93U
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q96RI1n/a93U5yxje5yxjA1A:244-471
Q96RI1n/a93U5yxje5yxjB1B:244-471