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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Melanin-concentrating hormone receptor 1' and Ligand = 'BDBM50152455'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50152455
PNG
(8-[3-(4-Chloro-3-trifluoromethyl-benzylamino)-prop...)
Show SMILES Nc1ccc2cccc(OCCCNCc3ccc(Cl)c(c3)C(F)(F)F)c2n1
Show InChI InChI=1S/C20H19ClF3N3O/c21-16-7-5-13(11-15(16)20(22,23)24)12-26-9-2-10-28-17-4-1-3-14-6-8-18(25)27-19(14)17/h1,3-8,11,26H,2,9-10,12H2,(H2,25,27)
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Concentration required to inhibit binding of [125I]-MCH radioligand to human Melanin-concentrating hormone receptor 1 in IMR-32 I3.4.2 cell membranes


Bioorg Med Chem Lett 14: 4883-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.035
BindingDB Entry DOI: 10.7270/Q2GB23H4
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50152455
PNG
(8-[3-(4-Chloro-3-trifluoromethyl-benzylamino)-prop...)
Show SMILES Nc1ccc2cccc(OCCCNCc3ccc(Cl)c(c3)C(F)(F)F)c2n1
Show InChI InChI=1S/C20H19ClF3N3O/c21-16-7-5-13(11-15(16)20(22,23)24)12-26-9-2-10-28-17-4-1-3-14-6-8-18(25)27-19(14)17/h1,3-8,11,26H,2,9-10,12H2,(H2,25,27)
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Concentration required to inhibit binding of [125I]-MCH radioligand to human Melanin-concentrating hormone receptor 1 in IMR-32 I3.4.2 cell membranes


Bioorg Med Chem Lett 14: 4879-82 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.034
BindingDB Entry DOI: 10.7270/Q2M32V61
More data for this
Ligand-Target Pair