Ligand name: 4-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-1-(4-fluorophenyl)butan-1-one
PDB ligand accession: GMJ
DrugBank: DB00502
PubChem: 3559
ChEMBL: CHEMBL54
InChI Key: LNEPOXFFQSENCJ-UHFFFAOYSA-N
SMILES: c1cc(ccc1C(=O)CCCN2CCC(CC2)(c3ccc(cc3)Cl)O)F

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic oxygen compounds
    • Class: Organooxygen compounds
      • Subclass: Carbonyl compounds

List of proteins that are targets for DB00502

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	P50406_GMJ	P50406	n/a	Ki(nM) = 1083.0
2	P08913_GMJ	P08913	n/a	Ki(nM) = 600.0
3	Q99705_GMJ	Q99705	n/a
4	Q13224_GMJ	Q13224	antagonist
5	P18825_GMJ	P18825	n/a	Ki(nM) = 550.0
6	P35462_GMJ	P35462	inverse agonist	Ki(nM) = 0.2 IC50(nM) = 0.06
7	P08908_GMJ	P08908	n/a	Ki(nM) = 1202.0 IC50(nM) = 1500.0
8	P21728_GMJ	P21728	antagonist	Ki(nM) = 6.17
9	Q99720_GMJ	Q99720	n/a	Ki(nM) = 0.2 IC50(nM) = 2.1
10	P35348_GMJ	P35348	n/a	Ki(nM) = 6.1
11	P28223_GMJ	P28223	antagonist	Ki(nM) = 20.0 IC50(nM) = 288.0
12	P14416_GMJ	P14416	antagonist	Ki(nM) = 0.12 IC50(nM) = 0.16 Kd(nM) = 0.489779
13	P34969_GMJ	P34969	n/a	Ki(nM) = 316.0
14	P28335_GMJ	P28335	antagonist	Ki(nM) = 35.71 IC50(nM) = 10000.0
15	P9WFK7_GMJ	P9WFK7	n/a	Ki(nM) = 390.0 IC50(nM) = 390.0
16	P35367_GMJ	P35367	n/a	Ki(nM) = 260.0
17	P18089_GMJ	P18089	n/a	Ki(nM) = 480.0
18	P20309_GMJ	P20309	n/a	Ki(nM) = 4670.0