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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 = 'BDBM50317719'   
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))
BDBM50317719
PNG
((4-cyclobutyl-1,4-diazepan-1-yl)((2R,4S)-1-cyclobu...)
Show SMILES Fc1ccc(O[C@H]2C[C@@H](N(C2)C2CCC2)C(=O)N2CCCN(CC2)C2CCC2)cc1 |r|
Show InChI InChI=1S/C24H34FN3O2/c25-18-8-10-21(11-9-18)30-22-16-23(28(17-22)20-6-2-7-20)24(29)27-13-3-12-26(14-15-27)19-4-1-5-19/h8-11,19-20,22-23H,1-7,12-17H2/t22-,23+/m0/s1
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Similars

Article
PubMed
17n/an/an/an/an/an/an/an/a



Johnson& Johnson Pharmaceutical Research& Development L.L.C.

Curated by ChEMBL


Assay Description
Binding affinity to human histamine H3 receptor


Bioorg Med Chem Lett 20: 2755-60 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.071
BindingDB Entry DOI: 10.7270/Q2Z60P7S
More data for this
Ligand-Target Pair