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Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Glycogen synthase kinase-3 beta' and Ligand = 'BDBM293466'   
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
Glycogen synthase kinase-3 beta


(Homo sapiens (Human))
BDBM293466
PNG
(US10106527, Compound 74 | US10544128, Compound 74 ...)
Show SMILES CN1CCN(Cc2cccc(c2)C(=O)Nc2cc3cc(ccc3cn2)-c2cnn(C)c2)CC1
Show InChI InChI=1S/C26H28N6O/c1-30-8-10-32(11-9-30)17-19-4-3-5-21(12-19)26(33)29-25-14-23-13-20(6-7-22(23)15-27-25)24-16-28-31(2)18-24/h3-7,12-16,18H,8-11,17H2,1-2H3,(H,27,29,33)
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US Patent
n/an/an/an/a 4.12E+3n/an/an/a25



Samumed, LLC

US Patent


Assay Description
Briefly, recombinant GSK3β kinase, ATP and Ser/Thr peptide 09 are prepared in 1× Kinase buffer to final concentrations of 0.04 μg/mL, 46 &#...


US Patent US10106527 (2018)


BindingDB Entry DOI: 10.7270/Q2PN97Q3
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3 beta


(Homo sapiens (Human))
BDBM293466
PNG
(US10106527, Compound 74 | US10544128, Compound 74 ...)
Show SMILES CN1CCN(Cc2cccc(c2)C(=O)Nc2cc3cc(ccc3cn2)-c2cnn(C)c2)CC1
Show InChI InChI=1S/C26H28N6O/c1-30-8-10-32(11-9-30)17-19-4-3-5-21(12-19)26(33)29-25-14-23-13-20(6-7-22(23)15-27-25)24-16-28-31(2)18-24/h3-7,12-16,18H,8-11,17H2,1-2H3,(H,27,29,33)
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n/an/an/an/a 4.12E+3n/an/an/an/a


TBA



Citation and Details

BindingDB Entry DOI: 10.7270/Q2SJ1QR6
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3 beta


(Homo sapiens (Human))
BDBM293466
PNG
(US10106527, Compound 74 | US10544128, Compound 74 ...)
Show SMILES CN1CCN(Cc2cccc(c2)C(=O)Nc2cc3cc(ccc3cn2)-c2cnn(C)c2)CC1
Show InChI InChI=1S/C26H28N6O/c1-30-8-10-32(11-9-30)17-19-4-3-5-21(12-19)26(33)29-25-14-23-13-20(6-7-22(23)15-27-25)24-16-28-31(2)18-24/h3-7,12-16,18H,8-11,17H2,1-2H3,(H,27,29,33)
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n/an/an/an/a 4.12E+3n/an/an/an/a



Samumed, LLC

US Patent


Assay Description
The GSK3β kinase assay is run using the Ser/Thr 09 peptide Z-lyte assay kit according to manufacturer's instructions (Life Technologies—a Di...


US Patent US10544128 (2020)


BindingDB Entry DOI: 10.7270/Q2H134DS
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3 beta


(Homo sapiens (Human))
BDBM293466
PNG
(US10106527, Compound 74 | US10544128, Compound 74 ...)
Show SMILES CN1CCN(Cc2cccc(c2)C(=O)Nc2cc3cc(ccc3cn2)-c2cnn(C)c2)CC1
Show InChI InChI=1S/C26H28N6O/c1-30-8-10-32(11-9-30)17-19-4-3-5-21(12-19)26(33)29-25-14-23-13-20(6-7-22(23)15-27-25)24-16-28-31(2)18-24/h3-7,12-16,18H,8-11,17H2,1-2H3,(H,27,29,33)
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US Patent
n/an/an/an/a 4.12E+3n/an/an/an/a



Tanabe Research Laboratories USA



Assay Description
The GSK3β kinase assay is run using the Ser/Thr 09 peptide Z-lyte assay kit according to manufacturer's instructions (Life Technologiesa Div...


Bioorg Med Chem Lett 17: 4442-6 (2007)


BindingDB Entry DOI: 10.7270/Q2862JRD
More data for this
Ligand-Target Pair