Ligand name: 4-[(8-methyl-4-oxidanylidene-7-prop-1-ynyl-3~{H}-quinazolin-2-yl)methylsulfanyl]benzoic acid
PDB ligand accession: EE5
DrugBank: n/a
PubChem: 137332079
ChEMBL: CHEMBL5207717
InChI Key: RMIJZTKTCJJVSA-UHFFFAOYSA-N
SMILES: CC#Cc1ccc2c(c1C)N=C(NC2=O)CSc3ccc(cc3)C(=O)O
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 Q460N5

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6FZM	Download	Experimental	e6fzmA1 e6fzmB1	ADP-ribosylation ADP-ribosylation	LigPlot