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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 = 'BDBM50220982'   
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))
BDBM50220982
PNG
(CHEMBL65311)
Show SMILES C(CN1CCCC1)C#Cc1c2CCCCCc2nc2ccccc12
Show InChI InChI=1S/C22H26N2/c1-2-11-19-18(10-6-7-15-24-16-8-9-17-24)20-12-4-5-14-22(20)23-21(19)13-3-1/h4-5,12,14H,1-3,7-9,11,13,15-17H2
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PC cid
PC sid
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Similars

PubMed
214n/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))
BDBM50220982
PNG
(CHEMBL65311)
Show SMILES C(CN1CCCC1)C#Cc1c2CCCCCc2nc2ccccc12
Show InChI InChI=1S/C22H26N2/c1-2-11-19-18(10-6-7-15-24-16-8-9-17-24)20-12-4-5-14-22(20)23-21(19)13-3-1/h4-5,12,14H,1-3,7-9,11,13,15-17H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
646n/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