Ligand name: 4-methoxy-3-(3-methoxypropoxy)-N-{[(3S,4S)-4-{[(4-methylphenyl)sulfonyl]amino}pyrrolidin-3-yl]methyl}-N-(propan-2-yl)benzamide
PDB ligand accession: 3ZK
DrugBank: n/a
PubChem: 91664005
ChEMBL: CHEMBL3400460
InChI Key: RCXREJXZQYBNRM-LADGPHEKSA-N
SMILES: Cc1ccc(cc1)S(=O)(=O)NC2CNCC2CN(C(C)C)C(=O)c3ccc(c(c3)OCCCOC)OC
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein P00797

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4RYC	Download	Experimental	e4rycA1 e4rycA2 e4rycB1 e4rycB2	cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel	LigPlot