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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Melanin-concentrating hormone receptor' and Ligand = 'BDBM50301098'   
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


(Homo sapiens (Human))
BDBM50301098
PNG
(4-(4-fluorobenzyloxy)-1-(2-(5-((propylamino)methyl...)
Show SMILES CCCNCc1ccc(CCn2ccc(OCc3ccc(F)cc3)cc2=O)nc1
Show InChI InChI=1S/C23H26FN3O2/c1-2-11-25-15-19-5-8-21(26-16-19)9-12-27-13-10-22(14-23(27)28)29-17-18-3-6-20(24)7-4-18/h3-8,10,13-14,16,25H,2,9,11-12,15,17H2,1H3
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GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 7n/an/an/an/an/an/a



Tsukuba Research Institute

Curated by ChEMBL


Assay Description
Antagonistic activity against MCH1R expressed on CHOK1 cells assessed as intracellular calcium mobilization by FLIPR


Bioorg Med Chem Lett 19: 5186-90 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.023
BindingDB Entry DOI: 10.7270/Q2G44QCG
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (Human))
BDBM50301098
PNG
(4-(4-fluorobenzyloxy)-1-(2-(5-((propylamino)methyl...)
Show SMILES CCCNCc1ccc(CCn2ccc(OCc3ccc(F)cc3)cc2=O)nc1
Show InChI InChI=1S/C23H26FN3O2/c1-2-11-25-15-19-5-8-21(26-16-19)9-12-27-13-10-22(14-23(27)28)29-17-18-3-6-20(24)7-4-18/h3-8,10,13-14,16,25H,2,9,11-12,15,17H2,1H3
Reactome pathway
KEGG

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 27n/an/an/an/an/an/a



Tsukuba Research Institute

Curated by ChEMBL


Assay Description
Antagonistic activity against MCH1R expressed on CHOK1 cells assessed as intracellular calcium mobilization by FLIPR


Bioorg Med Chem Lett 19: 5186-90 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.023
BindingDB Entry DOI: 10.7270/Q2G44QCG
More data for this
Ligand-Target Pair