Ligand name: 7-({3-ethyl-5-[(methylamino)methyl]phenoxy}methyl)quinolin-2-amine
PDB ligand accession: 8J4
DrugBank: n/a
PubChem: 124136897
ChEMBL: CHEMBL4117695
InChI Key: OCTNSHZDWVJCQD-UHFFFAOYSA-N
SMILES: CCc1cc(cc(c1)OCc2ccc3ccc(nc3c2)N)CNC
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
5UNS	Download	Experimental	e5unsA1 e5unsB1	Nitric oxide (NO) synthase oxygenase domain Nitric oxide (NO) synthase oxygenase domain	LigPlot