Ligand name: (2S)-2-{5-[(5-{[(1S)-1-(4-tert-butylphenyl)ethyl]carbamoyl}-2,3-dimethyl-1H-indol-1-yl)methyl]-2-chlorophenoxy}propanoic acid
PDB ligand accession: A8R
DrugBank: n/a
PubChem: 71075102
ChEMBL: CHEMBL3678128
InChI Key: NPMSSJHJPGMEJW-UNMCSNQZSA-N
SMILES: Cc1c(n(c2c1cc(cc2)C(=O)NC(C)c3ccc(cc3)C(C)(C)C)Cc4ccc(c(c4)OC(C)C(=O)O)Cl)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
8B8X	Download	Experimental	e8b8xA1 e8b8xB1	Nuclear receptor ligand-binding domain Nuclear receptor ligand-binding domain	LigPlot
7SQA	Download	Experimental	e7sqaA1 e7sqaB1	Nuclear receptor ligand-binding domain Nuclear receptor ligand-binding domain	LigPlot
7SQB	Download	Experimental	e7sqbA1	Nuclear receptor ligand-binding domain	LigPlot