Ligand name: 2-[4-(diethylamino)phenyl]-3~{H}-quinazolin-4-one
PDB ligand accession: 9C8
DrugBank: n/a
PubChem: 56973383;135567251;
ChEMBL: n/a
InChI Key: AGDCTQRHSRXCCI-UHFFFAOYSA-N
SMILES: CCN(CC)c1ccc(cc1)C2=Nc3ccccc3C(=O)N2
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
5NWD	Download	Experimental	e5nwdA1 e5nwdH1 e5nwdB1 e5nwdI1	ADP-ribosylation ADP-ribosylation ADP-ribosylation ADP-ribosylation	LigPlot