Ligand name: 3-[(5-{[3-(2,6-dichlorophenyl)-5-(1-methylethyl)isoxazol-4-yl]methoxy}-1H-indol-1-yl)methyl]benzoic acid
PDB ligand accession: 088
DrugBank: n/a
PubChem: 25167372
ChEMBL: CHEMBL562086
InChI Key: FCSGTZIUJUNGAC-UHFFFAOYSA-N
SMILES: CC(C)c1c(c(no1)c2c(cccc2Cl)Cl)COc3ccc4c(c3)ccn4Cc5cccc(c5)C(=O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Indoles and derivatives
      • Subclass: N-alkylindoles

List of PDB structures and/or AlphaFold models with target protein Q96RI1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3HC6	Download	Experimental	e3hc6A1	Nuclear receptor ligand-binding domain	LigPlot