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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 = 'BDBM50412469'   
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))
BDBM50412469
PNG
(CHEMBL459756)
Show SMILES C(Cc1ccc(cc1)-c1ccc(CN2CCCCC2)cc1)N1CCCCC1
Show InChI InChI=1S/C25H34N2/c1-3-16-26(17-4-1)20-15-22-7-11-24(12-8-22)25-13-9-23(10-14-25)21-27-18-5-2-6-19-27/h7-14H,1-6,15-21H2
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Article
PubMed
2n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Parma

Curated by ChEMBL


Assay Description
Displacement of [3H]RAMHA from human histamine H3 receptor expressed in SK-N-MC cells


Bioorg Med Chem 16: 9911-24 (2008)


Article DOI: 10.1016/j.bmc.2008.10.029
BindingDB Entry DOI: 10.7270/Q2FQ9XVP
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50412469
PNG
(CHEMBL459756)
Show SMILES C(Cc1ccc(cc1)-c1ccc(CN2CCCCC2)cc1)N1CCCCC1
Show InChI InChI=1S/C25H34N2/c1-3-16-26(17-4-1)20-15-22-7-11-24(12-8-22)25-13-9-23(10-14-25)21-27-18-5-2-6-19-27/h7-14H,1-6,15-21H2
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PubMed
2n/an/an/an/an/an/an/an/a



BIOPROJET-BIOTECH

Curated by ChEMBL


Assay Description
Binding affinity to histamine H3 receptor (unknown origin)


Bioorg Med Chem 21: 4526-9 (2013)


Article DOI: 10.1016/j.bmc.2013.05.035
BindingDB Entry DOI: 10.7270/Q2J9699Q
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50412469
PNG
(CHEMBL459756)
Show SMILES C(Cc1ccc(cc1)-c1ccc(CN2CCCCC2)cc1)N1CCCCC1
Show InChI InChI=1S/C25H34N2/c1-3-16-26(17-4-1)20-15-22-7-11-24(12-8-22)25-13-9-23(10-14-25)21-27-18-5-2-6-19-27/h7-14H,1-6,15-21H2
PDB

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Article
PubMed
8.32n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Parma

Curated by ChEMBL


Assay Description
Displacement of [3H]RAMHA from histamine H3 receptor in Wistar rat brain membrane


Bioorg Med Chem 16: 9911-24 (2008)


Article DOI: 10.1016/j.bmc.2008.10.029
BindingDB Entry DOI: 10.7270/Q2FQ9XVP
More data for this
Ligand-Target Pair