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BDBM50190889 2-(6-(3-cyanophenyl)-1-(1-cycloheptylpiperidin-4-yl)-3,4-dihydroisoquinolin-2(1H)-yl)-N-(3,5-dichlorophenyl)acetamide::CHEMBL408332

SMILES: Clc1cc(Cl)cc(NC(=O)CN2CCc3cc(ccc3C2C2CCN(CC2)C2CCCCCC2)-c2cccc(c2)C#N)c1

InChI Key: InChIKey=SDCCZLAUOPATRC-UHFFFAOYSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50190889   
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))
BDBM50190889
PNG
(2-(6-(3-cyanophenyl)-1-(1-cycloheptylpiperidin-4-y...)
Show SMILES Clc1cc(Cl)cc(NC(=O)CN2CCc3cc(ccc3C2C2CCN(CC2)C2CCCCCC2)-c2cccc(c2)C#N)c1
Show InChI InChI=1S/C36H40Cl2N4O/c37-30-20-31(38)22-32(21-30)40-35(43)24-42-17-14-29-19-28(27-7-5-6-25(18-27)23-39)10-11-34(29)36(42)26-12-15-41(16-13-26)33-8-3-1-2-4-9-33/h5-7,10-11,18-22,26,33,36H,1-4,8-9,12-17,24H2,(H,40,43)
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Similars

Article
PubMed
9.70n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity to human MCHR1


Bioorg Med Chem Lett 16: 4917-21 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.055
BindingDB Entry DOI: 10.7270/Q2WW7H83
More data for this
Ligand-Target Pair