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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 = 'BDBM50386361'   
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))
BDBM50386361
PNG
(CHEMBL2048413)
Show SMILES O=C1CCCCN1c1nnc(s1)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C17H27N5OS/c23-15-6-2-5-11-22(15)17-19-18-16(24-17)21-12-7-14(8-13-21)20-9-3-1-4-10-20/h14H,1-13H2
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PC cid
PC sid
UniChem
Article
PubMed
120n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant histamine H3 receptor after 30 mins by scintillation counting


ACS Med Chem Lett 3: 198-202 (2012)


Article DOI: 10.1021/ml200250t
BindingDB Entry DOI: 10.7270/Q2736S0M
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Mus musculus)
BDBM50386361
PNG
(CHEMBL2048413)
Show SMILES O=C1CCCCN1c1nnc(s1)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C17H27N5OS/c23-15-6-2-5-11-22(15)17-19-18-16(24-17)21-12-7-14(8-13-21)20-9-3-1-4-10-20/h14H,1-13H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
120n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from mouse recombinant histamine H3 receptor after 30 mins by scintillation counting


ACS Med Chem Lett 3: 198-202 (2012)


Article DOI: 10.1021/ml200250t
BindingDB Entry DOI: 10.7270/Q2736S0M
More data for this
Ligand-Target Pair