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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Histamine H3 receptor' and Ligand = 'BDBM50053278'   
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))
BDBM50053278
PNG
(4-[3-(1H-Imidazol-4-yl)-propoxy]-benzonitrile | 4-...)
Show SMILES N#Cc1ccc(OCCCc2cnc[nH]2)cc1
Show InChI InChI=1S/C13H13N3O/c14-8-11-3-5-13(6-4-11)17-7-1-2-12-9-15-10-16-12/h3-6,9-10H,1-2,7H2,(H,15,16)
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Article
PubMed
12n/an/an/an/an/an/an/an/a



University College London

Curated by ChEMBL


Assay Description
Rat Histamine H3 receptor antagonism determined by [K+] - evoked depolarization-induced release of [3H]-histamine from rat cerebral cortex synaptosom...


J Med Chem 39: 3806-13 (1996)


Article DOI: 10.1021/jm960138l
BindingDB Entry DOI: 10.7270/Q20P0Z3F
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50053278
PNG
(4-[3-(1H-Imidazol-4-yl)-propoxy]-benzonitrile | 4-...)
Show SMILES N#Cc1ccc(OCCCc2cnc[nH]2)cc1
Show InChI InChI=1S/C13H13N3O/c14-8-11-3-5-13(6-4-11)17-7-1-2-12-9-15-10-16-12/h3-6,9-10H,1-2,7H2,(H,15,16)
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PubMed
12n/an/an/an/an/an/an/an/a



Freie Universit£t Berlin

Curated by ChEMBL


Assay Description
Effect on histamine H3 receptors in vitro, on synaptosomes of rat cerebral cortex for the release of [3H]histamine


J Med Chem 43: 3987-94 (2000)


BindingDB Entry DOI: 10.7270/Q2833SRN
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50053278
PNG
(4-[3-(1H-Imidazol-4-yl)-propoxy]-benzonitrile | 4-...)
Show SMILES N#Cc1ccc(OCCCc2cnc[nH]2)cc1
Show InChI InChI=1S/C13H13N3O/c14-8-11-3-5-13(6-4-11)17-7-1-2-12-9-15-10-16-12/h3-6,9-10H,1-2,7H2,(H,15,16)
PDB

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UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Patents


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Article
PubMed
12n/an/an/an/an/an/an/an/a



University College London

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against against histamine H3 receptor using [3H]-Histamine as radioligand from rat cerebral cortex synaptosomes


J Med Chem 47: 3264-74 (2004)


Article DOI: 10.1021/jm031141p
BindingDB Entry DOI: 10.7270/Q2F47NK5
More data for this
Ligand-Target Pair