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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 = 'BDBM50171584'   
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))
BDBM50171584
PNG
(5-Chloro-N-(1-quinolin-6-ylmethyl-piperidin-4-yl)-...)
Show SMILES Clc1ccc(NCc2nccs2)c(c1)C(=O)NC1CCN(Cc2ccc3ncccc3c2)CC1
Show InChI InChI=1S/C26H26ClN5OS/c27-20-4-6-24(30-16-25-29-10-13-34-25)22(15-20)26(33)31-21-7-11-32(12-8-21)17-18-3-5-23-19(14-18)2-1-9-28-23/h1-6,9-10,13-15,21,30H,7-8,11-12,16-17H2,(H,31,33)
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Article
PubMed
n/an/a 20n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity towards melanin-concentrating hormone receptor 1 in IMR32 cells


Bioorg Med Chem Lett 15: 4174-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.06.089
BindingDB Entry DOI: 10.7270/Q2N29WGN
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50171584
PNG
(5-Chloro-N-(1-quinolin-6-ylmethyl-piperidin-4-yl)-...)
Show SMILES Clc1ccc(NCc2nccs2)c(c1)C(=O)NC1CCN(Cc2ccc3ncccc3c2)CC1
Show InChI InChI=1S/C26H26ClN5OS/c27-20-4-6-24(30-16-25-29-10-13-34-25)22(15-20)26(33)31-21-7-11-32(12-8-21)17-18-3-5-23-19(14-18)2-1-9-28-23/h1-6,9-10,13-15,21,30H,7-8,11-12,16-17H2,(H,31,33)
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 30n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory concentration against MCH1R IMR32 cells in FLIPR-based assay


Bioorg Med Chem Lett 15: 4174-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.06.089
BindingDB Entry DOI: 10.7270/Q2N29WGN
More data for this
Ligand-Target Pair