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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histamine H1 receptor' and Ligand = 'BDBM50336078'   
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 H1 receptor


(Homo sapiens (Human))
BDBM50336078
PNG
(2-((2-(2-(3-fluoropyrrolidin-1-yl)ethyl)-1H-inden-...)
Show SMILES FC1CCN(CCC2=C(Cc3cnccn3)c3ccccc3C2)C1 |c:7|
Show InChI InChI=1S/C20H22FN3/c21-17-6-10-24(14-17)9-5-16-11-15-3-1-2-4-19(15)20(16)12-18-13-22-7-8-23-18/h1-4,7-8,13,17H,5-6,9-12,14H2
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Similars

Article
PubMed
10.5n/an/an/an/an/an/an/an/a



Neurocrine Biosciences

Curated by ChEMBL


Assay Description
Binding affinity to histamine H1 receptor


Bioorg Med Chem Lett 21: 947-51 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.053
BindingDB Entry DOI: 10.7270/Q2319W59
More data for this
Ligand-Target Pair