Ligand name: (3S,5R)-N-{[9-(4-methoxybutyl)-9H-xanthen-9-yl]methyl}-5-{[(4-methylphenyl)sulfonyl]amino}piperidine-3-carboxamide
PDB ligand accession: 0N0
DrugBank: n/a
PubChem: 11963435
ChEMBL: CHEMBL2322207
InChI Key: LBPUIWQYAGTBDC-LOSJGSFVSA-N
SMILES: Cc1ccc(cc1)S(=O)(=O)NC2CC(CNC2)C(=O)NCC3(c4ccccc4Oc5c3cccc5)CCCCOC
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Benzopyrans
      • Subclass: 1-benzopyrans

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
4GJD	Download	Experimental	e4gjdA2 e4gjdA3 e4gjdB2 e4gjdB3	cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel	LigPlot