Ligand name: 4-(2-{[(2-aminoquinolin-7-yl)methyl]amino}ethyl)-2-methylbenzonitrile
PDB ligand accession: 9P7
DrugBank: n/a
PubChem: 121250396
ChEMBL: CHEMBL4068062
InChI Key: OFELXUWNGBXCPK-UHFFFAOYSA-N
SMILES: Cc1cc(ccc1C#N)CCNCc2ccc3ccc(nc3c2)N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Quinolines and derivatives
      • Subclass: Aminoquinolines and derivatives

List of PDB structures and/or AlphaFold models with target protein P29476

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5VUR	Download	Experimental	e5vurA1 e5vurB1	Nitric oxide (NO) synthase oxygenase domain Nitric oxide (NO) synthase oxygenase domain	LigPlot