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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 = 'BDBM50360901'   
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))
BDBM50360901
PNG
(CHEMBL1935113)
Show SMILES CC1CC(=O)NN=C1c1ccc(OCCCN2CCCCC2)cc1 |c:6|
Show InChI InChI=1S/C19H27N3O2/c1-15-14-18(23)20-21-19(15)16-6-8-17(9-7-16)24-13-5-12-22-10-3-2-4-11-22/h6-9,15H,2-5,10-14H2,1H3,(H,20,23)
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PC cid
PC sid
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Similars

Article
PubMed
21n/an/an/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]NAMH from human histamine H3 receptor expressed in CHO cells


Bioorg Med Chem Lett 22: 194-8 (2011)


Article DOI: 10.1016/j.bmcl.2011.11.037
BindingDB Entry DOI: 10.7270/Q25Q4WJV
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50360901
PNG
(CHEMBL1935113)
Show SMILES CC1CC(=O)NN=C1c1ccc(OCCCN2CCCCC2)cc1 |c:6|
Show InChI InChI=1S/C19H27N3O2/c1-15-14-18(23)20-21-19(15)16-6-8-17(9-7-16)24-13-5-12-22-10-3-2-4-11-22/h6-9,15H,2-5,10-14H2,1H3,(H,20,23)
PDB

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KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
28n/an/an/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]NAMH from rat histamine H3 receptor expressed in CHO cells


Bioorg Med Chem Lett 22: 194-8 (2011)


Article DOI: 10.1016/j.bmcl.2011.11.037
BindingDB Entry DOI: 10.7270/Q25Q4WJV
More data for this
Ligand-Target Pair