Ligand name: 4'-[(2,3-dimethyl-5-{[(1R)-1-(4-nitrophenyl)ethyl]carbamoyl}-1H-indol-1-yl)methyl]biphenyl-2-carboxylic acid
PDB ligand accession: 3K2
DrugBank: n/a
PubChem: 46846227
ChEMBL: CHEMBL3695811
InChI Key: IIJDFXNUWZTHIM-OAQYLSRUSA-N
SMILES: Cc1c(n(c2c1cc(cc2)C(=O)NC(C)c3ccc(cc3)[N+](=O)[O-])Cc4ccc(cc4)c5ccccc5C(=O)O)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Indoles and derivatives
      • Subclass: Indolecarboxylic acids and derivatives

List of PDB structures and/or AlphaFold models with target protein P37231

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4R6S	Download	Experimental	e4r6sA1 e4r6sB1	Nuclear receptor ligand-binding domain Nuclear receptor ligand-binding domain	LigPlot