Ligand name: {3-[(1R)-3-(3,4-dimethoxyphenyl)-1-({[(2S)-1-{[(1R,2S)-2-ethyl-1-hydroxycyclohexyl](oxo)acetyl}piperidin-2-yl]carbonyl}oxy)propyl]phenoxy}acetic acid
PDB ligand accession: 0MD
DrugBank: n/a
PubChem: 56962330
ChEMBL: CHEMBL2059034
InChI Key: JLRDMSUQFUWACS-RORDBKJESA-N
SMILES: CCC1CCCCC1(C(=O)C(=O)N2CCCCC2C(=O)OC(CCc3ccc(c(c3)OC)OC)c4cccc(c4)OCC(=O)O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Phenylpropanoids and polyketides
    • Class: Linear 1,3-diarylpropanoids
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein Q13451

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4DRO	Download	Experimental	e4droA1	FKBP-like	LigPlot
4DRP	Download	Experimental	e4drpA1	FKBP-like	LigPlot