Ligand name: N-[4-(4-OXO-3,4-DIHYDROQUINAZOLIN-2-YL)PHENYL]THIOPHENE-2-CARBOXAMIDE
PDB ligand accession: 16I
DrugBank: n/a
PubChem: 1300733;135414635;
ChEMBL: CHEMBL3431396
InChI Key: ZYFVSGVBEBJHCD-UHFFFAOYSA-N
SMILES: c1ccc2c(c1)C(=O)NC(=N2)c3ccc(cc3)NC(=O)c4cccs4
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Anilides

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
4BUV	Download	Experimental	e4buvA1 e4buvC1	ADP-ribosylation ADP-ribosylation	LigPlot