Ligand name: (9beta,13alpha)-3-hydroxyestra-1,3,5(10)-trien-17-one
PDB ligand accession: J3Z
DrugBank: DB00655
PubChem: 5870
ChEMBL: CHEMBL1405
InChI Key: DNXHEGUUPJUMQT-CBZIJGRNSA-N
SMILES: CC12CCC3c4ccc(cc4CCC3C1CCC2=O)O

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Lipids and lipid-like molecules
    • Class: Steroids and steroid derivatives
      • Subclass: Estrane steroids

List of proteins that are targets for J3Z

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	P03372_J3Z	P03372	agonist	IC50(nM) = 29.0 EC50(nM) = 0.7
2	P04278_J3Z	P04278	n/a	Kd(nM) = 6.6
3	P14061_J3Z	P14061	n/a	Ki(nM) = 3.0 IC50(nM) = 109.0
4	P10275_J3Z	P10275	n/a
5	P07445_J3Z	P07445	n/a
6	Q92731_J3Z	Q92731	n/a	IC50(nM) = 31.0 EC50(nM) = 0.5
7	Q9BPX1_J3Z	Q9BPX1	n/a
8	P11511_J3Z	P11511	n/a