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Target
Glycogen synthase kinase-3 beta
Ligand
BDBM35657
Substrate
GSK-3 Substrate Peptide
Meas. Tech.
Ki Determination
Ki
395±n/a nM
Citation
 Aronov, AM; Tang, Q; Martinez-Botella, G; Bemis, GW; Cao, J; Chen, G; Ewing, NP; Ford, PJ; Germann, UA; Green, J; Hale, MR; Jacobs, M; Janetka, JW; Maltais, F; Markland, W; Namchuk, MN; Nanthakumar, S; Poondru, S; Straub, J; ter Haar, E; Xie, X Structure-guided design of potent and selective pyrimidylpyrrole inhibitors of extracellular signal-regulated kinase (ERK) using conformational control. J Med Chem 52:6362-8 (2009) [PubMed]  Article  BDB Entry
Target
Name:
Glycogen synthase kinase-3 beta
Synonyms:
GSK-3 beta | GSK-3, beta | 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:
BDBM35657
Synonyms:
pyrimidylpyrrole, 11e
Type:
Small organic molecule
Emp. Form.:
C24H20Cl2FN5O2
Mol. Mass.:
500.352
SMILES:
Cc1cnc(Nc2ccc(F)cc2Cl)nc1-c1c[nH]c(c1)C(=O)N[C@H](CO)c1cccc(Cl)c1 |r|
Structure:
Search PDB for entries with ligand similarity:
Substrate
Name:
GSK-3 Substrate Peptide
Synonyms:
n/a
Type:
Peptide
Mol. Mass.:
1641.04
Organism:
n/a
Description:
n/a
Residue:
14
Sequence:
HSSPHQSPHEDEEE