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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 = 'BDBM50412461'   
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))
BDBM50412461
PNG
(CHEMBL457004)
Show SMILES CC1CC(C)CN(Cc2ccc(cc2)-c2ccc(CN3CCCCC3)cc2)C1
Show InChI InChI=1S/C26H36N2/c1-21-16-22(2)18-28(17-21)20-24-8-12-26(13-9-24)25-10-6-23(7-11-25)19-27-14-4-3-5-15-27/h6-13,21-22H,3-5,14-20H2,1-2H3
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PC cid
PC sid
UniChem

Similars

Article
PubMed
0.871n/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


(Rattus norvegicus (rat))
BDBM50412461
PNG
(CHEMBL457004)
Show SMILES CC1CC(C)CN(Cc2ccc(cc2)-c2ccc(CN3CCCCC3)cc2)C1
Show InChI InChI=1S/C26H36N2/c1-21-16-22(2)18-28(17-21)20-24-8-12-26(13-9-24)25-10-6-23(7-11-25)19-27-14-4-3-5-15-27/h6-13,21-22H,3-5,14-20H2,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
2.40n/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