Ligand name: 4-[3-OXO-3-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRO-NAPHTHALEN-2-YL)-PROPENYL]-BENZOIC ACID
PDB ligand accession: 156
DrugBank: DB02466
PubChem: 445576
ChEMBL: CHEMBL95700
InChI Key: ZXQHMEUGMCXKLO-KPKJPENVSA-N
SMILES: CC1(CCC(c2c1ccc(c2)C(=O)C=Cc3ccc(cc3)C(=O)O)(C)C)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Phenylpropanoids and polyketides
    • Class: Linear 1,3-diarylpropanoids
      • Subclass: Chalcones and dihydrochalcones

List of drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein P13631

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1FCZ	Download	Experimental	e1fczA1	Nuclear receptor ligand-binding domain	LigPlot