Ligand name: (2S)-2-(4-methoxy-3-{[(pyren-1-ylcarbonyl)amino]methyl}benzyl)butanoic acid
PDB ligand accession: 13M
DrugBank: n/a
PubChem: 25112371
ChEMBL: CHEMBL1956149
InChI Key: WXYOTFKPGLXJBW-IBGZPJMESA-N
SMILES: CCC(Cc1ccc(c(c1)CNC(=O)c2ccc3ccc4cccc5c4c3c2cc5)OC)C(=O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Pyrenes
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein Q07869

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3VI8	Download	Experimental	e3vi8A1	Nuclear receptor ligand-binding domain	LigPlot