Ligand name: 4-(4-oxo-4H-chromen-2-yl)benzonitrile
PDB ligand accession: 1UZ
DrugBank: n/a
PubChem: 45116983
ChEMBL: CHEMBL2431802
InChI Key: VDQXIGZGRYCKAE-UHFFFAOYSA-N
SMILES: c1ccc2c(c1)C(=O)C=C(O2)c3ccc(cc3)C#N
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
4L0S	Download	Experimental	e4l0sA1 e4l0sC1 e4l0sB1 e4l0sD1	ADP-ribosylation ADP-ribosylation ADP-ribosylation ADP-ribosylation	LigPlot