PDB ligand accession: JU0
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: FNCLKJPMEFPXOR-QFACEVIFSA-N
SMILES: c1c(cc(c(c1F)F)F)c2cn(nn2)C3C(C(OC(C3O)Sc4cc(cnc4)Br)CO)O
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organosulfur compounds
- Class: Thioethers
- Subclass: Aryl thioethers
- Class: Thioethers
- Superclass: Organosulfur compounds
# | DrugDomain Data | UniProt Accession | Protein name | Drug Action | Affinity data |
---|---|---|---|---|---|
1 | P17931_JU0 | P17931 | Galectin-3 (Gal-3) (35 | n/a |