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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 = 'BDBM50188824'   
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))
BDBM50188824
PNG
(3-(6-(3-(dimethylamino)pyrrolidin-1-yl)pyridin-3-y...)
Show SMILES CN(C)C1CCN(C1)c1ccc(cn1)-c1coc2cc(Oc3ccccc3)ccc2c1=O
Show InChI InChI=1S/C26H25N3O3/c1-28(2)19-12-13-29(16-19)25-11-8-18(15-27-25)23-17-31-24-14-21(9-10-22(24)26(23)30)32-20-6-4-3-5-7-20/h3-11,14-15,17,19H,12-13,16H2,1-2H3
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PC cid
PC sid
UniChem

Similars

Article
PubMed
7.20n/an/an/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Binding affinity to human MCH1R


Bioorg Med Chem Lett 16: 4237-42 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.075
BindingDB Entry DOI: 10.7270/Q2N29XRN
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50188824
PNG
(3-(6-(3-(dimethylamino)pyrrolidin-1-yl)pyridin-3-y...)
Show SMILES CN(C)C1CCN(C1)c1ccc(cn1)-c1coc2cc(Oc3ccccc3)ccc2c1=O
Show InChI InChI=1S/C26H25N3O3/c1-28(2)19-12-13-29(16-19)25-11-8-18(15-27-25)23-17-31-24-14-21(9-10-22(24)26(23)30)32-20-6-4-3-5-7-20/h3-11,14-15,17,19H,12-13,16H2,1-2H3
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 24n/an/an/an/an/an/a



Neurocrine Biosciences Inc.

Curated by ChEMBL


Assay Description
Activity at human MCH1R by GTPgammaS assay


Bioorg Med Chem Lett 16: 4237-42 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.075
BindingDB Entry DOI: 10.7270/Q2N29XRN
More data for this
Ligand-Target Pair