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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histamine H3 receptor' and Ligand = 'BDBM50333529'   
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
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50333529
PNG
(2-(4-methoxyphenyl)-5-(4-(pyrrolidin-1-yl)piperidi...)
Show SMILES COc1ccc(cc1)-c1nnc(s1)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C18H24N4OS/c1-23-16-6-4-14(5-7-16)17-19-20-18(24-17)22-12-8-15(9-13-22)21-10-2-3-11-21/h4-7,15H,2-3,8-13H2,1H3
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Similars

Article
PubMed
601n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor expressed in HEK cells after 30 mins by scintillation count...


Bioorg Med Chem Lett 21: 861-4 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.065
BindingDB Entry DOI: 10.7270/Q20V8D24
More data for this
Ligand-Target Pair