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BDBM50215641 3-(3-chloro-4-fluorophenyl)-1-((3R,6S)-6-(3-cyanophenyl)bicyclo[4.1.0]heptan-3-yl)-1-((1-(methylsulfonyl)piperidin-4-yl)methyl)urea::CHEMBL229871

SMILES: CS(=O)(=O)N1CCC(CN([C@@H]2CC[C@@]3(CC3C2)c2cccc(c2)C#N)C(=O)Nc2ccc(F)c(Cl)c2)CC1

InChI Key: InChIKey=WRWSEAQZUQAVSE-FKCQOYNMSA-N

Data: 2 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50215641   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/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))
BDBM50215641
PNG
(3-(3-chloro-4-fluorophenyl)-1-((3R,6S)-6-(3-cyanop...)
Show SMILES CS(=O)(=O)N1CCC(CN([C@@H]2CC[C@@]3(CC3C2)c2cccc(c2)C#N)C(=O)Nc2ccc(F)c(Cl)c2)CC1 |w:15.16|
Show InChI InChI=1S/C28H32ClFN4O3S/c1-38(36,37)33-11-8-19(9-12-33)18-34(27(35)32-23-5-6-26(30)25(29)15-23)24-7-10-28(16-22(28)14-24)21-4-2-3-20(13-21)17-31/h2-6,13,15,19,22,24H,7-12,14,16,18H2,1H3,(H,32,35)/t22?,24-,28-/m1/s1
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KEGG

UniProtKB/SwissProt

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GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
7.19n/an/an/an/an/an/an/an/a



Universidad de Cartagena

Curated by ChEMBL


Assay Description
Antagonist activity at MCH1 receptor


Eur J Med Chem 45: 4509-22 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.011
BindingDB Entry DOI: 10.7270/Q2FT8N9V
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50215641
PNG
(3-(3-chloro-4-fluorophenyl)-1-((3R,6S)-6-(3-cyanop...)
Show SMILES CS(=O)(=O)N1CCC(CN([C@@H]2CC[C@@]3(CC3C2)c2cccc(c2)C#N)C(=O)Nc2ccc(F)c(Cl)c2)CC1 |w:15.16|
Show InChI InChI=1S/C28H32ClFN4O3S/c1-38(36,37)33-11-8-19(9-12-33)18-34(27(35)32-23-5-6-26(30)25(29)15-23)24-7-10-28(16-22(28)14-24)21-4-2-3-20(13-21)17-31/h2-6,13,15,19,22,24H,7-12,14,16,18H2,1H3,(H,32,35)/t22?,24-,28-/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

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



Schering-Plough Research Institute K15 2545

Curated by ChEMBL


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


Bioorg Med Chem 15: 5369-85 (2007)


Article DOI: 10.1016/j.bmc.2007.05.068
BindingDB Entry DOI: 10.7270/Q25T3K5V
More data for this
Ligand-Target Pair