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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 = 'BDBM50051192'   
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


(Rattus norvegicus (rat))
BDBM50051192
PNG
((4-Nitro-phenyl)-carbamic acid 3-(1H-imidazol-4-yl...)
Show SMILES [O-][N+](=O)c1ccc(NC(=O)OCCCc2cnc[nH]2)cc1
Show InChI InChI=1S/C13H14N4O4/c18-13(21-7-1-2-11-8-14-9-15-11)16-10-3-5-12(6-4-10)17(19)20/h3-6,8-9H,1-2,7H2,(H,14,15)(H,16,18)
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PC cid
PC sid
UniChem

Similars

Article
PubMed
19.9n/an/an/an/an/an/an/an/a



Freie Universität Berlin

Curated by ChEMBL


Assay Description
Binding affinity against Histamine H3 receptor on Synaptosomes from rat cerebral cortex was evaluated


J Med Chem 39: 1157-63 (1996)


Article DOI: 10.1021/jm9507688
BindingDB Entry DOI: 10.7270/Q2SF2V7G
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50051192
PNG
((4-Nitro-phenyl)-carbamic acid 3-(1H-imidazol-4-yl...)
Show SMILES [O-][N+](=O)c1ccc(NC(=O)OCCCc2cnc[nH]2)cc1
Show InChI InChI=1S/C13H14N4O4/c18-13(21-7-1-2-11-8-14-9-15-11)16-10-3-5-12(6-4-10)17(19)20/h3-6,8-9H,1-2,7H2,(H,14,15)(H,16,18)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

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



Freie Universität Berlin

Curated by ChEMBL


Assay Description
In vitro antagonistic activity of the compound against Histamine H3 receptor on Synaptosomes of rat cerebral cortex.


J Med Chem 39: 1157-63 (1996)


Article DOI: 10.1021/jm9507688
BindingDB Entry DOI: 10.7270/Q2SF2V7G
More data for this
Ligand-Target Pair