Ligand name: 3-(4-oxo-3,4-dihydroquinazolin-2-yl)-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]propanamide
PDB ligand accession: 1VB
DrugBank: n/a
PubChem: 25620222;135566843;
ChEMBL: n/a
InChI Key: HHRFLQNTWASYFZ-LBPRGKRZSA-N
SMILES: CC(c1ccc(cc1)S(=O)(=O)N)NC(=O)CCC2=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 Q9Y6F1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4L7N	Download	Experimental	e4l7nA1 e4l7nA2	ADP-ribosylation Domain of poly(ADP-ribose) polymerase	LigPlot