Ligand name: 5-[[(2~{R},3~{S})-2-[(1~{R})-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholin-4-yl]methyl]-1,2-dihydro-1,2,4-triazol-3-one
PDB ligand accession: GBQ
DrugBank: DB00673
PubChem: 6918365;135413536;
ChEMBL: CHEMBL1471
InChI Key: ATALOFNDEOCMKK-OITMNORJSA-N
SMILES: CC(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)OC2C(N(CCO2)CC3=NC(=O)NN3)c4ccc(cc4)F

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Oxazinanes
      • Subclass: Morpholines

List of proteins that are targets for DB00673

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	P25103_GBQ	P25103	antagonist	Ki(nM) = 0.0794 IC50(nM) = 0.09