Ligand name: 4-(4-{[2-(4-chlorophenyl)-5,5-dimethylcyclohex-1-en-1-yl]methyl}piperazin-1-yl)-N-[(4-{[(2R)-4-(morpholin-4-yl)-1-(phenylsulfanyl)butan-2-yl]amino}-3-[(trifluoromethyl)sulfonyl]phenyl)sulfonyl]benzamide
PDB ligand accession: 1XJ
DrugBank: DB12340
PubChem: 24978538
ChEMBL: CHEMBL443684
InChI Key: JLYAXFNOILIKPP-KXQOOQHDSA-N
SMILES: CC1(CCC(=C(C1)CN2CCN(CC2)c3ccc(cc3)C(=O)NS(=O)(=O)c4ccc(c(c4)S(=O)(=O)C(F)(F)F)NC(CCN5CCOCC5)CSc6ccccc6)c7ccc(cc7)Cl)C

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Diazinanes
      • Subclass: Piperazines

List of proteins that are targets for 1XJ

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	Q92843_1XJ	Q92843	inhibitor
2	P53563_1XJ	P53563	n/a
3	P10415_1XJ	P10415	inhibitor