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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 = 'BDBM50372290'   
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))
BDBM50372290
PNG
(CHEMBL269951)
Show SMILES C[C@H]1CCCN1CCc1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C20H25NO/c1-17-6-5-14-21(17)15-13-18-9-11-20(12-10-18)22-16-19-7-3-2-4-8-19/h2-4,7-12,17H,5-6,13-16H2,1H3/t17-/m0/s1
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PC cid
PC sid
UniChem

Similars

Article
PubMed
1.60n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity at human recombinant histamine H3 receptor expressed in HEK cells


Bioorg Med Chem Lett 18: 355-9 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.067
BindingDB Entry DOI: 10.7270/Q2VM4D4V
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50372290
PNG
(CHEMBL269951)
Show SMILES C[C@H]1CCCN1CCc1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C20H25NO/c1-17-6-5-14-21(17)15-13-18-9-11-20(12-10-18)22-16-19-7-3-2-4-8-19/h2-4,7-12,17H,5-6,13-16H2,1H3/t17-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
5.90n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity at rat recombinant histamine H3 receptor in rat cortical membranes


Bioorg Med Chem Lett 18: 355-9 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.067
BindingDB Entry DOI: 10.7270/Q2VM4D4V
More data for this
Ligand-Target Pair