Ligand name: 2-[(2,6-dichloro-3-methyl-phenyl)amino]benzoic acid
PDB ligand accession: JMS
DrugBank: DB00939
PubChem: 4037
ChEMBL: CHEMBL509
InChI Key: SBDNJUWAMKYJOX-UHFFFAOYSA-N
SMILES: Cc1ccc(c(c1Cl)Nc2ccccc2C(=O)O)Cl
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein P42330

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3R6I	Download	Experimental	e3r6iA1	TIM beta/alpha-barrel	LigPlot