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Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Histamine H2 receptor' and Ligand = 'BDBM22881'   
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 H2 receptor


(Cavia porcellus (domestic guinea pig))
BDBM22881
PNG
(5-(2-aminoethyl)-4-methyl-1,3-thiazol-2-amine | Am...)
Show SMILES Cc1nc(N)sc1CCN
Show InChI InChI=1S/C6H11N3S/c1-4-5(2-3-7)10-6(8)9-4/h2-3,7H2,1H3,(H2,8,9)
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Article
PubMed
n/an/an/an/a 617n/an/an/an/a



University of Regensburg

Curated by ChEMBL


Assay Description
Agonist activity at H2R in spontaneously beating guinea pig right atrium assessed as increase in heart rate


J Med Chem 55: 1147-60 (2012)


Article DOI: 10.1021/jm201128q
BindingDB Entry DOI: 10.7270/Q2HQ411W
More data for this
Ligand-Target Pair
Histamine H2 receptor


(RAT)
BDBM22881
PNG
(5-(2-aminoethyl)-4-methyl-1,3-thiazol-2-amine | Am...)
Show SMILES Cc1nc(N)sc1CCN
Show InChI InChI=1S/C6H11N3S/c1-4-5(2-3-7)10-6(8)9-4/h2-3,7H2,1H3,(H2,8,9)
KEGG

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Article
n/an/an/a 1.15E+4n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Affinity to the Histamine H2 receptor was determined expressed in CHO cell using [125I]iodoaminopotentidine as radioligand


Bioorg Med Chem Lett 4: 1913-1916 (1994)


Article DOI: 10.1016/S0960-894X(01)80533-3
BindingDB Entry DOI: 10.7270/Q2TD9ZHX
More data for this
Ligand-Target Pair
Histamine H2 receptor


(Cavia porcellus (domestic guinea pig))
BDBM22881
PNG
(5-(2-aminoethyl)-4-methyl-1,3-thiazol-2-amine | Am...)
Show SMILES Cc1nc(N)sc1CCN
Show InChI InChI=1S/C6H11N3S/c1-4-5(2-3-7)10-6(8)9-4/h2-3,7H2,1H3,(H2,8,9)
UniProtKB/SwissProt

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Article
PubMed
n/an/an/a 5.01E+3n/an/an/an/an/a



Vrije Universiteit

Curated by ChEMBL


Assay Description
Compound is evaluated for histamine H2 receptor agonistic activity in guinea pig cerebral cortex using [3H]tiotidine as radioligand


J Med Chem 35: 3239-46 (1992)


Article DOI: 10.1021/jm00095a021
BindingDB Entry DOI: 10.7270/Q2C53N4J
More data for this
Ligand-Target Pair
Histamine H2 receptor


(Cavia porcellus (domestic guinea pig))
BDBM22881
PNG
(5-(2-aminoethyl)-4-methyl-1,3-thiazol-2-amine | Am...)
Show SMILES Cc1nc(N)sc1CCN
Show InChI InChI=1S/C6H11N3S/c1-4-5(2-3-7)10-6(8)9-4/h2-3,7H2,1H3,(H2,8,9)
UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 191n/an/an/an/a



University of Regensburg

Curated by ChEMBL


Assay Description
Agonist activity at guinea pig H2R-Gsalphas expressed in Sf9 cells at 0.1 nM to 10 uM by steady state GTPase activity assay


J Med Chem 55: 1147-60 (2012)


Article DOI: 10.1021/jm201128q
BindingDB Entry DOI: 10.7270/Q2HQ411W
More data for this
Ligand-Target Pair