Ligand name: 4-[4-[(1~{R})-1-(6-methoxy-1,3-benzodioxol-5-yl)-2-pyrrolidin-1-yl-ethyl]phenyl]-~{N}-[4-[[(2~{R})-4-morpholin-4-yl-1-phenylsulfanyl-butan-2-yl]amino]-3-(trifluoromethylsulfonyl)phenyl]sulfonyl-benzamide
PDB ligand accession: J1T
DrugBank: n/a
PubChem: 138393394
ChEMBL: n/a
InChI Key: VYXUKAAOZUKPPQ-GXJHCLHJSA-N
SMILES: COc1cc2c(cc1C(CN3CCCC3)c4ccc(cc4)c5ccc(cc5)C(=O)NS(=O)(=O)c6ccc(c(c6)S(=O)(=O)C(F)(F)F)NC(CCN7CCOCC7)CSc8ccccc8)OCO2

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Biphenyls and derivatives

List of proteins that are targets for J1T

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	P10415_J1T	P10415	n/a