Ligand name: methyl (2-{(R)-(3-chlorophenyl)[(3R)-1-({(2S)-1-(methylamino)-3-[(3R)-tetrahydro-2H-pyran-3-yl]propan-2-yl}carbamoyl)piperidin-3-yl]methoxy}ethyl)carbamate
PDB ligand accession: RX6
DrugBank: n/a
PubChem: 53497561
ChEMBL: CHEMBL2024248
InChI Key: GCNDDOJRCKHYLZ-ZXMXYHOLSA-N
SMILES: CNCC(CC1CCCOC1)NC(=O)N2CCCC(C2)C(c3cccc(c3)Cl)OCCNC(=O)OC
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Piperidines
      • Subclass: Piperidinecarboxylic acids and derivatives

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
3Q5H	Download	Experimental	e3q5hA2 e3q5hA3 e3q5hB3 e3q5hA2 e3q5hA3 e3q5hB2 e3q5hB3	cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel	LigPlot