Ligand name: N-[4-methyl-3-[6-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinazolin-3-yl]phenyl]-2-morpholin-4-yl-pyridine-4-carboxamide
PDB ligand accession: AA0
DrugBank: n/a
PubChem: 22238181
ChEMBL: CHEMBL2031219
InChI Key: BLSPWFIREKMTOA-UHFFFAOYSA-N
SMILES: Cc1ccc(cc1N2C=Nc3ccc(cc3C2=O)N4CCN(CC4)C)NC(=O)c5ccnc(c5)N6CCOCC6
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 Q16539

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4AA0	Download	Experimental	e4aa0A2	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot