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Compile Data Set for Download or QSAR

Found 2 hits with Last Name = 'frech' and Initial = 'mj'   
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))
BDBM50326901
PNG
(3-(4-fluorophenethylamino)-1-methyl-4-(2-methyl-1H...)
Show SMILES CN1C(=O)C(NCCc2ccc(F)cc2)=C(C1=O)c1c(C)[nH]c2ccccc12 |c:15|
Show InChI InChI=1S/C22H20FN3O2/c1-13-18(16-5-3-4-6-17(16)25-13)19-20(22(28)26(2)21(19)27)24-12-11-14-7-9-15(23)10-8-14/h3-10,24-25H,11-12H2,1-2H3
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MCE
PC cid
PC sid
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Article
PubMed
n/an/a 53n/an/an/an/an/an/a



University of Rostock

Curated by ChEMBL


Assay Description
Inhibition of GSK3beta after 30 mins by luminescence assay


Bioorg Med Chem 18: 6785-95 (2010)


Article DOI: 10.1016/j.bmc.2010.07.045
BindingDB Entry DOI: 10.7270/Q2B27VGP
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3 beta


(Homo sapiens (Human))
BDBM8296
PNG
(3-(2,4-dichlorophenyl)-4-(1-methyl-1H-indol-3-yl)-...)
Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2ccc(Cl)cc2Cl)c2ccccc12 |t:4|
Show InChI InChI=1S/C19H12Cl2N2O2/c1-23-9-13(11-4-2-3-5-15(11)23)17-16(18(24)22-19(17)25)12-7-6-10(20)8-14(12)21/h2-9H,1H3,(H,22,24,25)
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MCE
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UniChem

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Similars

Article
PubMed
n/an/a 92n/an/an/an/an/an/a



University of Rostock

Curated by ChEMBL


Assay Description
Inhibition of GSK3beta after 30 mins by luminescence assay


Bioorg Med Chem 18: 6785-95 (2010)


Article DOI: 10.1016/j.bmc.2010.07.045
BindingDB Entry DOI: 10.7270/Q2B27VGP
More data for this
Ligand-Target Pair