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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 = 'BDBM50462996'   
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))
BDBM50462996
PNG
(CHEMBL4242249)
Show SMILES Clc1nc(N2CCC(CC2)N2CCCCC2)c2ccn(Cc3ccc4ccccc4c3)c2n1
Show InChI InChI=1S/C27H30ClN5/c28-27-29-25(32-15-10-23(11-16-32)31-13-4-1-5-14-31)24-12-17-33(26(24)30-27)19-20-8-9-21-6-2-3-7-22(21)18-20/h2-3,6-9,12,17-18,23H,1,4-5,10-11,13-16,19H2
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PC cid
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Article
PubMed
126n/an/an/an/an/an/an/an/a



Pontificia Universidad Cat£lica de Chile

Curated by ChEMBL


Assay Description
Displacement of [3H]Nalpha-methylhistamine from human H3 receptor


Bioorg Med Chem Lett 28: 2890-2893 (2018)


Article DOI: 10.1016/j.bmcl.2018.07.023
BindingDB Entry DOI: 10.7270/Q2GH9MM2
More data for this
Ligand-Target Pair