Ligand name: N-(1-benzylpiperidin-4-yl)-6,7-dimethoxy-2-(4-methyl-1,4-diazepan-1-yl)quinazolin-4-amine
PDB ligand accession: Q4A
DrugBank: n/a
PubChem: 25150857
ChEMBL: CHEMBL569864
InChI Key: OSXFATOLZGZLSK-UHFFFAOYSA-N
SMILES: CN1CCCN(CC1)c2nc3cc(c(cc3c(n2)NC4CCN(CC4)Cc5ccccc5)OC)OC
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Piperidines
      • Subclass: Benzylpiperidines

List of PDB structures and/or AlphaFold models with target protein Q9H9B1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3FPD	Download	Experimental	e3fpdA1 e3fpdB2	beta-clip beta-clip	LigPlot