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BDBM50184942 CHEMBL380692::N'-(3-chloro-4-fluorophenyl)-N-[trans-3-(3-cyanophenyl)cyclopentyl]-N-[3-(4-methyl-1-piperazinyl)propyl]urea

SMILES: CN1CCN(CCCN([C@@H]2CC[C@H](C2)c2cccc(c2)C#N)C(=O)Nc2ccc(F)c(Cl)c2)CC1

InChI Key: InChIKey=KIHMJDSKWULNPW-ISKFKSNPSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50184942   
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))
BDBM50184942
PNG
(CHEMBL380692 | N'-(3-chloro-4-fluorophenyl)-N-[tra...)
Show SMILES CN1CCN(CCCN([C@@H]2CC[C@H](C2)c2cccc(c2)C#N)C(=O)Nc2ccc(F)c(Cl)c2)CC1
Show InChI InChI=1S/C27H33ClFN5O/c1-32-12-14-33(15-13-32)10-3-11-34(27(35)31-23-7-9-26(29)25(28)18-23)24-8-6-22(17-24)21-5-2-4-20(16-21)19-30/h2,4-5,7,9,16,18,22,24H,3,6,8,10-15,17H2,1H3,(H,31,35)/t22-,24-/m1/s1
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PC cid
PC sid
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Similars

Article
PubMed
161n/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