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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 = 'BDBM50207676'   
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))
BDBM50207676
PNG
(CHEMBL245642 | N-(1-(3-fluoro-4-(2-(methoxyimino)e...)
Show SMILES CO\N=C\COc1ccc(CN2CCC(CC2)NC(=O)c2cc(=O)c3ccc(F)cc3o2)cc1F
Show InChI InChI=1S/C25H25F2N3O5/c1-33-28-8-11-34-22-5-2-16(12-20(22)27)15-30-9-6-18(7-10-30)29-25(32)24-14-21(31)19-4-3-17(26)13-23(19)35-24/h2-5,8,12-14,18H,6-7,9-11,15H2,1H3,(H,29,32)/b28-8+
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PC sid
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Article
PubMed
n/an/a 31n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Displacement of [125I]MCH from MCHR1 expressed in IMR32 cells


Bioorg Med Chem Lett 17: 2365-71 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.068
BindingDB Entry DOI: 10.7270/Q2N29WNW
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50207676
PNG
(CHEMBL245642 | N-(1-(3-fluoro-4-(2-(methoxyimino)e...)
Show SMILES CO\N=C\COc1ccc(CN2CCC(CC2)NC(=O)c2cc(=O)c3ccc(F)cc3o2)cc1F
Show InChI InChI=1S/C25H25F2N3O5/c1-33-28-8-11-34-22-5-2-16(12-20(22)27)15-30-9-6-18(7-10-30)29-25(32)24-14-21(31)19-4-3-17(26)13-23(19)35-24/h2-5,8,12-14,18H,6-7,9-11,15H2,1H3,(H,29,32)/b28-8+
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 480n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at MCHR1 assessed as inhibition of MCH-mediated calcium release in IMR32 cells


Bioorg Med Chem Lett 17: 2365-71 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.068
BindingDB Entry DOI: 10.7270/Q2N29WNW
More data for this
Ligand-Target Pair