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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Histamine H3 receptor' and Ligand = 'BDBM50200627'   
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))
BDBM50200627
PNG
(4-(6-(2-(diethylamino)ethyl)naphthalen-2-yl)benzon...)
Show SMILES CCN(CC)CCc1ccc2cc(ccc2c1)-c1ccc(cc1)C#N
Show InChI InChI=1S/C23H24N2/c1-3-25(4-2)14-13-18-5-10-23-16-22(12-11-21(23)15-18)20-8-6-19(17-24)7-9-20/h5-12,15-16H,3-4,13-14H2,1-2H3
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PC cid
PC sid
UniChem

Similars

Article
PubMed
0.840n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human cloned histamine H3 receptor expressed in C6 cells


Bioorg Med Chem Lett 17: 1443-6 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.073
BindingDB Entry DOI: 10.7270/Q2416WR3
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50200627
PNG
(4-(6-(2-(diethylamino)ethyl)naphthalen-2-yl)benzon...)
Show SMILES CCN(CC)CCc1ccc2cc(ccc2c1)-c1ccc(cc1)C#N
Show InChI InChI=1S/C23H24N2/c1-3-25(4-2)14-13-18-5-10-23-16-22(12-11-21(23)15-18)20-8-6-19(17-24)7-9-20/h5-12,15-16H,3-4,13-14H2,1-2H3
PDB

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KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
12.5n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from histamine H3 receptor in rat cortical membranes


Bioorg Med Chem Lett 17: 1443-6 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.073
BindingDB Entry DOI: 10.7270/Q2416WR3
More data for this
Ligand-Target Pair