Ligand name: N-CYCLOPROPYL-4-METHYL-3-[6-(4-METHYLPIPERAZIN-1-YL)-4-OXIDANYLIDENE-QUINAZOLIN-3-YL]BENZAMIDE
PDB ligand accession: NQB
DrugBank: n/a
PubChem: 11373432
ChEMBL: CHEMBL2031465
InChI Key: ZMAZXHICVRYLQN-UHFFFAOYSA-N
SMILES: Cc1ccc(cc1N2C=Nc3ccc(cc3C2=O)N4CCN(CC4)C)C(=O)NC5CC5
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Diazinanes
      • Subclass: Piperazines

List of PDB structures and/or AlphaFold models with target protein Q16539

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4AA5	Download	Experimental	e4aa5A1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot