Ligand name: 2-(4-methylphenyl)-4H-chromen-4-one
PDB ligand accession: 431
DrugBank: n/a
PubChem: 688829
ChEMBL: CHEMBL16861
InChI Key: OPHKKQQCOYMLPW-UHFFFAOYSA-N
SMILES: Cc1ccc(cc1)C2=CC(=O)c3ccccc3O2
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Phenylpropanoids and polyketides
    • Class: Flavonoids
      • Subclass: Flavones

List of PDB structures and/or AlphaFold models with target protein Q9H2K2

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4HLK	Download	Experimental	e4hlk.1 e4hlk.2	ADP-ribosylation ADP-ribosylation	LigPlot