Ligand name: 2-(4-methylsulfanylphenyl)-3H-quinazolin-4-one
PDB ligand accession: 91F
DrugBank: n/a
PubChem: 2207977;135476414;
ChEMBL: n/a
InChI Key: RINHPBSTNZTFJF-UHFFFAOYSA-N
SMILES: CSc1ccc(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
4BUA	Download	Experimental	e4buaA1 e4buaC1	ADP-ribosylation ADP-ribosylation	LigPlot