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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 = 'BDBM50220976'   
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))
BDBM50220976
PNG
(CHEMBL419993)
Show SMILES CN(C)CCCNc1c2CSCCc2nc2ccccc12
Show InChI InChI=1S/C17H23N3S/c1-20(2)10-5-9-18-17-13-6-3-4-7-15(13)19-16-8-11-21-12-14(16)17/h3-4,6-7H,5,8-12H2,1-2H3,(H,18,19)
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PC cid
PC sid
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Similars

PubMed
54n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards cloned human H3L receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220976
PNG
(CHEMBL419993)
Show SMILES CN(C)CCCNc1c2CSCCc2nc2ccccc12
Show InChI InChI=1S/C17H23N3S/c1-20(2)10-5-9-18-17-13-6-3-4-7-15(13)19-16-8-11-21-12-14(16)17/h3-4,6-7H,5,8-12H2,1-2H3,(H,18,19)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
59n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair