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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 = 'BDBM50220102'   
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


(Rattus norvegicus (rat))
BDBM50220102
PNG
(CHEMBL63632)
Show SMILES CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)S(=O)(=O)c2ccc(cc2)C#N)cc1
Show InChI InChI=1S/C26H33N3O4S/c1-2-3-4-6-26(30)23-9-11-24(12-10-23)33-20-5-15-28-16-18-29(19-17-28)34(31,32)25-13-7-22(21-27)8-14-25/h7-14H,2-6,15-20H2,1H3
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PC cid
PC sid
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Similars

PubMed
37n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for the rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 12: 2031-4 (2002)


BindingDB Entry DOI: 10.7270/Q2MK6G21
More data for this
Ligand-Target Pair