Ligand name: 6-{[(3R,4R)-4-(2-{[2-(3-fluorophenyl)ethyl]amino}ethoxy)pyrrolidin-3-yl]methyl}-4-methylpyridin-2-amine
PDB ligand accession: JRR
DrugBank: n/a
PubChem: 46225774
ChEMBL: CHEMBL607146
InChI Key: NESZTSPBRDBHCW-XLIONFOSSA-N
SMILES: Cc1cc(nc(c1)N)CC2CNCC2OCCNCCc3cccc(c3)F
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Phenethylamines

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
3NLJ	Download	Experimental	e3nljA1 e3nljB1	Nitric oxide (NO) synthase oxygenase domain Nitric oxide (NO) synthase oxygenase domain	LigPlot
3NLQ	Download	Experimental	e3nlqA1 e3nlqB1	Nitric oxide (NO) synthase oxygenase domain Nitric oxide (NO) synthase oxygenase domain	LigPlot
3NLM	Download	Experimental	e3nlmA1 e3nlmB1	Nitric oxide (NO) synthase oxygenase domain Nitric oxide (NO) synthase oxygenase domain	LigPlot