Ligand name: 3-(6-{[3-(2,6-dichlorophenyl)-5-(1-methylethyl)isoxazol-4-yl]methoxy}-1-benzothiophen-2-yl)benzoic acid
PDB ligand accession: 82X
DrugBank: n/a
PubChem: 25166350
ChEMBL: CHEMBL558143
InChI Key: WPHVYHBQJIXGIJ-UHFFFAOYSA-N
SMILES: CC(C)c1c(c(no1)c2c(cccc2Cl)Cl)COc3ccc4cc(sc4c3)c5cccc(c5)C(=O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Benzothiophenes
      • Subclass: 1-benzothiophenes

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
3HC5	Download	Experimental	e3hc5A1	Nuclear receptor ligand-binding domain	LigPlot