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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histamine H2 Receptor' and Ligand = 'BDBM50156891'   
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 H2 Receptor


(Homo sapiens (Human))
BDBM50156891
PNG
(2-(3-((4-(1-(2-ethoxyethyl)-1H-indol-3-yl)piperidi...)
Show SMILES CCOCCn1cc(C2CCN(Cc3cccc(OCC(O)=O)c3)CC2)c2ccccc12
Show InChI InChI=1S/C26H32N2O4/c1-2-31-15-14-28-18-24(23-8-3-4-9-25(23)28)21-10-12-27(13-11-21)17-20-6-5-7-22(16-20)32-19-26(29)30/h3-9,16,18,21H,2,10-15,17,19H2,1H3,(H,29,30)
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.92E+3n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Displacement of [3H]ketanserine from histamine H2 receptor in human cortex membranes


J Med Chem 47: 6326-37 (2004)


Article DOI: 10.1021/jm0498203
BindingDB Entry DOI: 10.7270/Q2HM57XC
More data for this
Ligand-Target Pair