Ligand name: (1R,2S,3R,5Z,7E)-17-{(1R)-1-[(2-ethyl-2-hydroxybutyl)sulfanyl]ethyl}-2-(2-hydroxyethoxy)-9,10-secoestra-5,7,16-triene-1,3-diol
PDB ligand accession: VDB
DrugBank: n/a
PubChem: n/a
ChEMBL: CHEMBL514116
InChI Key: DUIYWCMQVXJTIP-XXAWZNHHSA-N
SMILES: CCC(CC)(CSC(C)C1=CCC2C1(CCCC2=CC=C3CC(C(C(C3)O)OCCO)O)C)O

ClassyFire chemical classification:

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

List of proteins that are targets for VDB

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	P13053_VDB	P13053	n/a