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

ClassyFire chemical classification:

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

List of proteins that are targets for AIT

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	P03372_AIT	P03372	n/a
2	P18031_AIT	P18031	n/a