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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 = 'BDBM26400'   
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))
BDBM26400
PNG
(2,4-diamino-5,6-disubstituted pyrimidine, 14 | 9-p...)
Show SMILES Nc1nc2C(CCCCc2c(n1)N1CCNCC1)c1ccccc1
Show InChI InChI=1S/C19H25N5/c20-19-22-17-15(14-6-2-1-3-7-14)8-4-5-9-16(17)18(23-19)24-12-10-21-11-13-24/h1-3,6-7,15,21H,4-5,8-13H2,(H2,20,22,23)
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PC cid
PC sid
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Similars

Article
PubMed
661n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]NAMH from rat histamine H3 receptor expressed in C6 cells after 1 hr by liquid scintillation counting


Bioorg Med Chem Lett 20: 1900-4 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.131
BindingDB Entry DOI: 10.7270/Q21V5G6X
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM26400
PNG
(2,4-diamino-5,6-disubstituted pyrimidine, 14 | 9-p...)
Show SMILES Nc1nc2C(CCCCc2c(n1)N1CCNCC1)c1ccccc1
Show InChI InChI=1S/C19H25N5/c20-19-22-17-15(14-6-2-1-3-7-14)8-4-5-9-16(17)18(23-19)24-12-10-21-11-13-24/h1-3,6-7,15,21H,4-5,8-13H2,(H2,20,22,23)
PDB

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UniProtKB/SwissProt

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GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
2.24E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]NAMH from human histamine H3 receptor expressed in C6 cells after 1 hr by liquid scintillation counting


Bioorg Med Chem Lett 20: 1900-4 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.131
BindingDB Entry DOI: 10.7270/Q21V5G6X
More data for this
Ligand-Target Pair