Ligand name: 2-[4-(trifluoromethyl)phenyl]-3H-quinazolin-4-one
PDB ligand accession: 06R
DrugBank: n/a
PubChem: 15141705;135566970;
ChEMBL: CHEMBL2419892
InChI Key: LSKQRMBPLLMJRR-UHFFFAOYSA-N
SMILES: c1ccc2c(c1)C(=O)NC(=N2)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
4UI3	Download	Experimental	e4ui3A1 e4ui3C1 e4ui3B1 e4ui3D1	ADP-ribosylation ADP-ribosylation ADP-ribosylation ADP-ribosylation	LigPlot