Ligand name: 2-(3-chlorophenoxy)-3-methoxy-4-{(1R)-1-[(3S)-3-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)piperidin-1-yl]propyl}benzoic acid
PDB ligand accession: 32B
DrugBank: n/a
PubChem: 74331719
ChEMBL: CHEMBL3297963
InChI Key: LWVFVEIAPUMILP-PGRDOPGGSA-N
SMILES: CCC(c1ccc(c(c1OC)Oc2cccc(c2)Cl)C(=O)O)N3CCCC(C3)N4C=C(C(=O)NC4=O)C
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein Q6GJI9

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4QGF	Download	Experimental	e4qgfA1 e4qgfB1	P-loop domains-like P-loop domains-like	LigPlot