Ligand name: 4-[(phenylmethyl)amino]benzoic acid
PDB ligand accession: S1G
DrugBank: n/a
PubChem: 853546
ChEMBL: CHEMBL32051
InChI Key: NYNAMTQEBMCHNG-UHFFFAOYSA-N
SMILES: c1ccc(cc1)CNc2ccc(cc2)C(=O)O
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 Q9BRQ3

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5R5B	Download	Experimental	e5r5bA1	beta-Grasp	LigPlot