Reaction Details |
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Target | Glycogen synthase kinase-3 beta |
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Ligand | BDBM50332533 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_695103 (CHEMBL1640851) |
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IC50 | 263±n/a nM |
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Citation | Khanfar, MA; Hill, RA; Kaddoumi, A; El Sayed, KA Discovery of novel GSK-3ß inhibitors with potent in vitro and in vivo activities and excellent brain permeability using combined ligand- and structure-based virtual screening. J Med Chem53:8534-45 (2010) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Glycogen synthase kinase-3 beta |
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Name: | Glycogen synthase kinase-3 beta |
Synonyms: | GSK-3 beta | GSK-3, beta | GSK3B | GSK3B_HUMAN | Glycogen synthase kinase 3 beta (GSK3B) | Glycogen synthase kinase 3-beta (GSK3B) | Glycogen synthase kinase-3 beta (GSK-3B) | Glycogen synthase kinase-3 beta (GSK3 Beta) | Glycogen synthase kinase-3 beta (GSK3B) | Glycogen synthase kinase-3B (GSK-3B) | Glycogen synthase kinase-3beta (GSK3B) | Serine/threonine-protein kinase GSK3B |
Type: | Enzyme |
Mol. Mass.: | 46756.38 |
Organism: | Homo sapiens (Human) |
Description: | P49841 |
Residue: | 420 |
Sequence: | MSGRPRTTSFAESCKPVQQPSAFGSMKVSRDKDGSKVTTVVATPGQGPDRPQEVSYTDTK
VIGNGSFGVVYQAKLCDSGELVAIKKVLQDKRFKNRELQIMRKLDHCNIVRLRYFFYSSG
EKKDEVYLNLVLDYVPETVYRVARHYSRAKQTLPVIYVKLYMYQLFRSLAYIHSFGICHR
DIKPQNLLLDPDTAVLKLCDFGSAKQLVRGEPNVSYICSRYYRAPELIFGATDYTSSIDV
WSAGCVLAELLLGQPIFPGDSGVDQLVEIIKVLGTPTREQIREMNPNYTEFKFPQIKAHP
WTKVFRPRTPPEAIALCSRLLEYTPTARLTPLEACAHSFFDELRDPNVKLPNGRDTPALF
NFTTQELSSNPPLATILIPPHARIQAAASTPTNATAASDANTGDRGQTNNAASASASNST
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BDBM50332533 |
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n/a |
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Name | BDBM50332533 |
Synonyms: | (Z)-3,3'-(4-((4-oxo-2-thioxothiazolidin-5-ylidene)methyl)phenylazanediyl)-dipropanoic acid | CHEMBL1630445 |
Type | Small organic molecule |
Emp. Form. | C16H16N2O5S2 |
Mol. Mass. | 380.439 |
SMILES | OC(=O)CCN(CCC(O)=O)c1ccc(C=C2SC(S)=NC2=O)cc1 |w:15.14,c:19| |
Structure |
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