Ligand name: 6-({2-[(5-chloro-2-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)pyridine-3-carboxylic acid
PDB ligand accession: 1E7
DrugBank: n/a
PubChem: 23605664
ChEMBL: CHEMBL2316891
InChI Key: XMYZLTXLDRMRAM-UHFFFAOYSA-N
SMILES: COc1ccc(cc1NC(=O)CSc2ccc(cn2)C(=O)O)Cl
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pyridines and derivatives
      • Subclass: Pyridinecarboxylic acids and derivatives

List of PDB structures and/or AlphaFold models with target protein P13491

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4I9U	Download	Experimental	e4i9uA4 e4i9uB2 e4i9uC2 e4i9uD2 e4i9uE2 e4i9uF2 e4i9uG2 e4i9uH2	Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like	LigPlot