Ligand name: 3-[(2-aminoquinolin-7-yl)methoxy]-5-[(methylamino)methyl]benzonitrile
PDB ligand accession: 8EV
DrugBank: n/a
PubChem: 124136877
ChEMBL: CHEMBL4116969
InChI Key: QYHMAWINXHLCMX-UHFFFAOYSA-N
SMILES: CNCc1cc(cc(c1)OCc2ccc3ccc(nc3c2)N)C#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 P29474

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5UO8	Download	Experimental	e5uo8A1 e5uo8B1 e5uo8C1 e5uo8D1 e5uo8D1	Nitric oxide (NO) synthase oxygenase domain Nitric oxide (NO) synthase oxygenase domain Nitric oxide (NO) synthase oxygenase domain Nitric oxide (NO) synthase oxygenase domain Nitric oxide (NO) synthase oxygenase domain	LigPlot