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Target
Mitogen-activated protein kinase 14
Ligand
BDBM236619
Substrate
n/a
Meas. Tech.
Acid Enzyme Assay
pH
7.5±n/a
Temperature
298.15±n/a K
IC50
5±n/a nM
Comments
extracted
Citation
 Pintat, S; Davies, SJ; Moffat, DF Tert-butyl N-[2-{4-[6-amino-5-(2,4-difluorobenzoyl)-2-oxopyridin-1(2H)-yl]-3,5-difluorophenyl}ethyl]-L-alaninate or a salt, hydrate or solvate thereof US Patent  US9388136 Publication Date 7/12/2016 
Target
Name:
Mitogen-activated protein kinase 14
Synonyms:
CSAID-binding protein | CSBP | CSBP1 | CSBP2 | CSPB1 | Cytokine suppressive anti-inflammatory drug-binding protein | MAP kinase 14 | MAP kinase MXI2 | MAP kinase p38 alpha | MAPK 14 | MAPK14 | MAX-interacting protein 2 | MK14_HUMAN | MXI2 | Mitogen-activated protein kinase p38 alpha | SAPK2A | Stress-activated protein kinase 2a | p38 MAP kinase alpha/beta
Type:
Serine/threonine-protein kinase
Mol. Mass.:
41286.76
Organism:
Homo sapiens (Human)
Description:
Q16539
Residue:
360
Sequence:
MSQERPTFYRQELNKTIWEVPERYQNLSPVGSGAYGSVCAAFDTKTGLRVAVKKLSRPFQSIIHAKRTYRELRLLKHMKHENVIGLLDVFTPARSLEEFNDVYLVTHLMGADLNNIVKCQKLTDDHVQFLIYQILRGLKYIHSADIIHRDLKPSNLAVNEDCELKILDFGLARHTDDEMTGYVATRWYRAPEIMLNWMHYNQTVDIWSVGCIMAELLTGRTLFPGTDHIDQLKLILRLVGTPGAELLKKISSESARNYIQSLTQMPKMNFANVFIGANPLAVDLLEKMLVLDSDKRITAAQALAHAYFAQYHDPDDEPVADPYDQSFESRDLLIDEWKSLTYDEVISFVPPPLDQEEMES
  
Inhibitor
Name:
BDBM236619
Synonyms:
US9388136, Table 1, Compound 11:Cyclopentyl (2S)-4-amino- 2-[(3-{4-[6-amino- 5-(2,4-difluoro- benzoyl)-2- oxopyridin- 1(2H)-yl]-3,5- difluoro- phenoxy}propyl) amino]butanoate
Type:
Small organic molecule
Emp. Form.:
C30H32F4N4O5
Mol. Mass.:
604.5925
SMILES:
NCC[C@H](NCCCOc1cc(F)c(c(F)c1)-n1c(N)c(ccc1=O)C(=O)c1ccc(F)cc1F)C(=O)OC1CCCC1 |r,wD:3.3,(8.82,-2.93,;8.82,-1.39,;7.48,-.62,;7.48,.92,;6.15,1.69,;4.82,.92,;3.48,1.69,;2.15,.92,;.82,1.69,;-.52,.92,;-1.85,1.69,;-3.19,.92,;-4.52,1.69,;-3.19,-.62,;-1.85,-1.39,;-1.85,-2.93,;-.52,-.62,;-4.52,-1.39,;-5.85,-.62,;-5.85,.92,;-7.19,-1.39,;-7.19,-2.93,;-5.85,-3.7,;-4.52,-2.93,;-3.19,-3.7,;-8.52,-.62,;-8.52,.92,;-9.85,-1.39,;-11.19,-.62,;-12.52,-1.39,;-12.52,-2.93,;-13.86,-3.7,;-11.19,-3.7,;-9.85,-2.93,;-8.52,-3.7,;8.82,1.69,;8.82,3.23,;10.15,.92,;11.49,1.69,;12.95,1.21,;13.86,2.46,;12.95,3.7,;11.49,3.23,)|
Structure:
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