Ligand name: 1-{[(3R)-3-methyl-4-({4-[(1S)-2,2,2-trifluoro-1-hydroxy-1-methylethyl]phenyl}sulfonyl)piperazin-1-yl]methyl}cyclopropanecarboxamide
PDB ligand accession: D4N
DrugBank: DB07624
PubChem: 24856362
ChEMBL: CHEMBL460962
InChI Key: YJFULAYRAKPBCY-DYVFJYSZSA-N
SMILES: CC1CN(CCN1S(=O)(=O)c2ccc(cc2)C(C)(C(F)(F)F)O)CC3(CC3)C(=O)N
Drug action: n/a

ClassyFire chemical classification:

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

List of drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein P28845

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3D4N	Download	Experimental	e3d4nA1 e3d4nB1 e3d4nC1 e3d4nD1	Rossmann-like Rossmann-like Rossmann-like Rossmann-like	LigPlot