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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 = 'BDBM50222973'   
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))
BDBM50222973
PNG
(CHEMBL26880)
Show SMILES O=C(N1CCCC1)c1ccc(cc1)-c1ccc(OCCCN2CCCC2)cc1
Show InChI InChI=1S/C24H30N2O2/c27-24(26-17-3-4-18-26)22-8-6-20(7-9-22)21-10-12-23(13-11-21)28-19-5-16-25-14-1-2-15-25/h6-13H,1-5,14-19H2
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PC cid
PC sid
UniChem

Similars

PubMed
1.10n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for human recombinant H3 receptor


Bioorg Med Chem Lett 13: 1325-8 (2003)


BindingDB Entry DOI: 10.7270/Q2HM59NM
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50222973
PNG
(CHEMBL26880)
Show SMILES O=C(N1CCCC1)c1ccc(cc1)-c1ccc(OCCCN2CCCC2)cc1
Show InChI InChI=1S/C24H30N2O2/c27-24(26-17-3-4-18-26)22-8-6-20(7-9-22)21-10-12-23(13-11-21)28-19-5-16-25-14-1-2-15-25/h6-13H,1-5,14-19H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
6.60n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards rat cortical H3 receptor


Bioorg Med Chem Lett 13: 1325-8 (2003)


BindingDB Entry DOI: 10.7270/Q2HM59NM
More data for this
Ligand-Target Pair