Ligand name: (3S)-3-(2H-1,3-benzodioxol-5-yl)-1-[(3R,5S)-3,5-dimethylpiperidin-1-yl]-3-(2-hydroxy-4,6-dimethoxyphenyl)propan-1-one
PDB ligand accession: 6Q6
DrugBank: n/a
PubChem: 71540860
ChEMBL: n/a
InChI Key: YEKVAIMYYCZDLI-FCEWJHQRSA-N
SMILES: CC1CC(CN(C1)C(=O)CC(c2ccc3c(c2)OCO3)c4c(cc(cc4OC)OC)O)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Phenols
      • Subclass: Methoxyphenols

List of PDB structures and/or AlphaFold models with target protein P51449

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5K3N	Download	Experimental	e5k3nA1 e5k3nB1 e5k3nC1 e5k3nD1	Nuclear receptor ligand-binding domain Nuclear receptor ligand-binding domain Nuclear receptor ligand-binding domain Nuclear receptor ligand-binding domain	LigPlot