Ligand name: N-methyl-1-[4-(1H-pyrazol-1-ylmethyl)phenyl]methanamine
PDB ligand accession: 3VR
DrugBank: n/a
PubChem: 18525877
ChEMBL: CHEMBL3581508
InChI Key: BQLXMVISWVMAID-UHFFFAOYSA-N
SMILES: CNCc1ccc(cc1)Cn2cccn2
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 P9WQ81

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4WYD	Download	Experimental	e4wydA1 e4wydA2 e4wydB2 e4wydA2 e4wydB1 e4wydB2	C-terminal domain in some PLP-dependent transferases PLP-dependent transferases PLP-dependent transferases PLP-dependent transferases C-terminal domain in some PLP-dependent transferases PLP-dependent transferases	LigPlot