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PubMed code 26496242

Compile data set for download or QSAR
Found 4 hits of Enzyme Inhibition Constant Data   
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 alpha


(Homo sapiens (Human))
BDBM50133388
PNG
(CHEMBL3632824)
Show SMILES NC(=O)c1cc(F)ccc1-c1ccc(CSc2nnc(o2)-c2ccc3OCCOc3c2)cc1
Show InChI InChI=1S/C24H18FN3O4S/c25-17-6-7-18(19(12-17)22(26)29)15-3-1-14(2-4-15)13-33-24-28-27-23(32-24)16-5-8-20-21(11-16)31-10-9-30-20/h1-8,11-12H,9-10,13H2,(H2,26,29)
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Article
PubMed
n/an/a 42n/an/an/an/an/an/a



Technische Universit£t Darmstadt

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GSK-3 alpha using Ulight-CFFKNIVTPRTPPPSQGK-amide substrate incubated for 60 mins by LANCE method relative to control


J Med Chem 58: 8907-19 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01200
BindingDB Entry DOI: 10.7270/Q2K64KW5
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3 beta


(Homo sapiens (Human))
BDBM50133388
PNG
(CHEMBL3632824)
Show SMILES NC(=O)c1cc(F)ccc1-c1ccc(CSc2nnc(o2)-c2ccc3OCCOc3c2)cc1
Show InChI InChI=1S/C24H18FN3O4S/c25-17-6-7-18(19(12-17)22(26)29)15-3-1-14(2-4-15)13-33-24-28-27-23(32-24)16-5-8-20-21(11-16)31-10-9-30-20/h1-8,11-12H,9-10,13H2,(H2,26,29)
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Article
PubMed
n/an/a 140n/an/an/an/an/an/a



Technische Universit£t Darmstadt

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GSK-3 beta using Ulight-CFFKNIVTPRTPPPSQGK-amide substrate incubated for 90 mins by LANCE method relative to control


J Med Chem 58: 8907-19 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01200
BindingDB Entry DOI: 10.7270/Q2K64KW5
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3 alpha


(Homo sapiens (Human))
BDBM50389083
PNG
(CHEMBL2064535)
Show SMILES Fc1ccc(-c2ccc(CSc3nnc(o3)-c3ccc4OCCOc4c3)cc2)c(c1)C#N
Show InChI InChI=1S/C24H16FN3O3S/c25-19-6-7-20(18(11-19)13-26)16-3-1-15(2-4-16)14-32-24-28-27-23(31-24)17-5-8-21-22(12-17)30-10-9-29-21/h1-8,11-12H,9-10,14H2
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Article
PubMed
n/an/a 230n/an/an/an/an/an/a



Technische Universit£t Darmstadt

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GSK-3 alpha using Ulight-CFFKNIVTPRTPPPSQGK-amide substrate incubated for 60 mins by LANCE method relative to control


J Med Chem 58: 8907-19 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01200
BindingDB Entry DOI: 10.7270/Q2K64KW5
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3 beta


(Homo sapiens (Human))
BDBM50389083
PNG
(CHEMBL2064535)
Show SMILES Fc1ccc(-c2ccc(CSc3nnc(o3)-c3ccc4OCCOc4c3)cc2)c(c1)C#N
Show InChI InChI=1S/C24H16FN3O3S/c25-19-6-7-20(18(11-19)13-26)16-3-1-15(2-4-16)14-32-24-28-27-23(31-24)17-5-8-21-22(12-17)30-10-9-29-21/h1-8,11-12H,9-10,14H2
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Article
PubMed
n/an/a>1.00E+3n/an/an/an/an/an/a



Technische Universit£t Darmstadt

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GSK-3 beta using Ulight-CFFKNIVTPRTPPPSQGK-amide substrate incubated for 90 mins by LANCE method relative to control


J Med Chem 58: 8907-19 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01200
BindingDB Entry DOI: 10.7270/Q2K64KW5
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%