Ligand name: (2S,3R)-3-(4-HYDROXYPHENYL)-2-(4-{[(2R)-2-PYRROLIDIN-1-YLPROPYL]OXY}PHENYL)-2,3-DIHYDRO-1,4-BENZOXATHIIN-6-OL
PDB ligand accession: AIT
DrugBank: DB02615
PubChem: 449209
ChEMBL: CHEMBL180792
InChI Key: UZOOIPXOYYJULJ-BLIZRMSTSA-N
SMILES: CC(COc1ccc(cc1)C2C(Sc3cc(ccc3O2)O)c4ccc(cc4)O)N5CCCC5
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Phenylpropanoids and polyketides
    • Class: Stilbenes
      • Subclass: None

List of drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein P03372

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1XPC	Download	Experimental	e1xpcA1	Nuclear receptor ligand-binding domain	LigPlot