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BDBM50184912 CHEMBL206498::N-[3-[trans-4-[[[(3-chloro-4-fluorophenyl)amino]carbonyl][3-(4-methyl-1-piperazinyl)propyl]amino]bicyclo[3.1.0]hex-1-yl]-phenyl]methanesulfonamide

SMILES: CN1CCN(CCCN([C@@H]2CC[C@@]3(C[C@H]23)c2cccc(NS(C)(=O)=O)c2)C(=O)Nc2ccc(F)c(Cl)c2)CC1

InChI Key: InChIKey=PJOFDORDRUWYLO-KODFZCBSSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50184912   
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


(Homo sapiens (Human))
BDBM50184912
PNG
(CHEMBL206498 | N-[3-[trans-4-[[[(3-chloro-4-fluoro...)
Show SMILES CN1CCN(CCCN([C@@H]2CC[C@@]3(C[C@H]23)c2cccc(NS(C)(=O)=O)c2)C(=O)Nc2ccc(F)c(Cl)c2)CC1
Show InChI InChI=1S/C28H37ClFN5O3S/c1-33-13-15-34(16-14-33)11-4-12-35(27(36)31-21-7-8-25(30)24(29)18-21)26-9-10-28(19-23(26)28)20-5-3-6-22(17-20)32-39(2,37)38/h3,5-8,17-18,23,26,32H,4,9-16,19H2,1-2H3,(H,31,36)/t23-,26-,28-/m1/s1
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Similars

Article
PubMed
394n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


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


J Med Chem 49: 2294-310 (2006)


Article DOI: 10.1021/jm050886n
BindingDB Entry DOI: 10.7270/Q2HQ3ZGH
More data for this
Ligand-Target Pair