Ligand name: 1-benzyl-1,4,5,6-tetrahydropyridine-3-carboxamide
PDB ligand accession: 536
DrugBank: n/a
PubChem: 12382031
ChEMBL: n/a
InChI Key: MSZLGNZPMBNYEO-UHFFFAOYSA-N
SMILES: c1ccc(cc1)CN2CCCC(=C2)C(=O)N
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein Q9R9V9

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5CPL	Download	Experimental	e5cplA1 e5cplB1	TIM beta/alpha-barrel TIM beta/alpha-barrel	LigPlot