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Target
Glycogen synthase kinase-3 beta
Ligand
BDBM50026845
Substrate
n/a
Meas. Tech.
ChEMBL_807282 (CHEMBL1960375)
IC50
316±n/a nM
Citation
 Gentile, G; Merlo, G; Pozzan, A; Bernasconi, G; Bax, B; Bamborough, P; Bridges, A; Carter, P; Neu, M; Yao, G; Brough, C; Cutler, G; Coffin, A; Belyanskaya, S 5-Aryl-4-carboxamide-1,3-oxazoles: potent and selective GSK-3 inhibitors. Bioorg Med Chem Lett 22:1989-94 (2012) [PubMed]  Article 
Target
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:
MSGRPRTTSFAESCKPVQQPSAFGSMKVSRDKDGSKVTTVVATPGQGPDRPQEVSYTDTKVIGNGSFGVVYQAKLCDSGELVAIKKVLQDKRFKNRELQIMRKLDHCNIVRLRYFFYSSGEKKDEVYLNLVLDYVPETVYRVARHYSRAKQTLPVIYVKLYMYQLFRSLAYIHSFGICHRDIKPQNLLLDPDTAVLKLCDFGSAKQLVRGEPNVSYICSRYYRAPELIFGATDYTSSIDVWSAGCVLAELLLGQPIFPGDSGVDQLVEIIKVLGTPTREQIREMNPNYTEFKFPQIKAHPWTKVFRPRTPPEAIALCSRLLEYTPTARLTPLEACAHSFFDELRDPNVKLPNGRDTPALFNFTTQELSSNPPLATILIPPHARIQAAASTPTNATAASDANTGDRGQTNNAASASASNST
  
Inhibitor
Name:
BDBM50026845
Synonyms:
CHEMBL1957079
Type:
Small organic molecule
Emp. Form.:
C21H27N3O4
Mol. Mass.:
385.4568
SMILES:
COc1ccc(cc1)-c1ocnc1C(=O)NCC1CCC(CC1)C(=O)N(C)C |(25.74,-6.11,;27.07,-5.34,;27.07,-3.8,;25.74,-3.03,;25.74,-1.49,;27.07,-.71,;28.41,-1.48,;28.41,-3.03,;27.07,.82,;28.31,1.73,;27.83,3.2,;26.29,3.19,;25.82,1.73,;24.48,.97,;24.46,-.57,;23.15,1.76,;21.81,1,;20.48,1.79,;20.5,3.34,;19.19,4.12,;17.84,3.38,;17.82,1.83,;19.14,1.04,;16.52,4.17,;16.54,5.71,;15.17,3.42,;13.85,4.21,;15.15,1.88,)|
Structure:
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