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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 = 'BDBM50051183'   
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))
BDBM50051183
PNG
((3-Trifluoromethyl-phenyl)-carbamic acid 3-(1H-imi...)
Show SMILES FC(F)(F)c1cccc(NC(=O)OCCCc2cnc[nH]2)c1
Show InChI InChI=1S/C14H14F3N3O2/c15-14(16,17)10-3-1-4-11(7-10)20-13(21)22-6-2-5-12-8-18-9-19-12/h1,3-4,7-9H,2,5-6H2,(H,18,19)(H,20,21)
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Similars

Article
PubMed
19n/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
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50051183
PNG
((3-Trifluoromethyl-phenyl)-carbamic acid 3-(1H-imi...)
Show SMILES FC(F)(F)c1cccc(NC(=O)OCCCc2cnc[nH]2)c1
Show InChI InChI=1S/C14H14F3N3O2/c15-14(16,17)10-3-1-4-11(7-10)20-13(21)22-6-2-5-12-8-18-9-19-12/h1,3-4,7-9H,2,5-6H2,(H,18,19)(H,20,21)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


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