Ligand name: 8-HYDROXY-2-[4-(TRIFLUOROMETHYL)PHENYL]-3,4-DIHYDROQUINAZOLIN-4-ONE
PDB ligand accession: IY5
DrugBank: n/a
PubChem: 10852153;135417291;
ChEMBL: CHEMBL151382
InChI Key: ZZCRCAHSCCNAPB-UHFFFAOYSA-N
SMILES: c1cc2c(c(c1)O)N=C(NC2=O)c3ccc(cc3)C(F)(F)F
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 Q9H2K2

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4UI8	Download	Experimental	e4ui8A1 e4ui8C1 e4ui8B1 e4ui8D1	ADP-ribosylation ADP-ribosylation ADP-ribosylation ADP-ribosylation	LigPlot