Ligand name: 1-[[4-fluoranyl-3-(3-oxidanylidene-4-propyl-piperazin-1-yl)carbonyl-phenyl]methyl]quinazoline-2,4-dione
PDB ligand accession: 6WX
DrugBank: n/a
PubChem: 122707105
ChEMBL: CHEMBL5427496
InChI Key: JJDFDZDTXGPNIC-UHFFFAOYSA-N
SMILES: CCCN1CCN(CC1=O)C(=O)c2cc(ccc2F)CN3c4ccccc4C(=O)NC3=O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Diazanaphthalenes
      • Subclass: Benzodiazines

List of PDB structures and/or AlphaFold models with target protein P09874

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5KPN	Download	Experimental	e5kpnA1 e5kpnA2 e5kpnB1 e5kpnB2	Domain of poly(ADP-ribose) polymerase ADP-ribosylation Domain of poly(ADP-ribose) polymerase ADP-ribosylation	LigPlot