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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 = 'BDBM50117896'   
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))
BDBM50117896
PNG
(CHEMBL89623 | [2-(2-Piperidin-1-yl-ethoxy)-9H-fluo...)
Show SMILES OCC1c2ccccc2-c2ccc(OCCN3CCCCC3)cc12
Show InChI InChI=1S/C21H25NO2/c23-15-21-18-7-3-2-6-17(18)19-9-8-16(14-20(19)21)24-13-12-22-10-4-1-5-11-22/h2-3,6-9,14,21,23H,1,4-5,10-13,15H2
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PubMed
570n/an/an/an/an/an/an/an/a



The Schering Plough Research Institute

Curated by ChEMBL


Assay Description
In vitro binding affinity for Histamine H3 receptor


Bioorg Med Chem Lett 12: 2643-6 (2002)


BindingDB Entry DOI: 10.7270/Q26Q1WMX
More data for this
Ligand-Target Pair