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Target
Mitogen-activated protein kinase 8
Ligand
BDBM50578345
Substrate
n/a
Meas. Tech.
ChEMBL_2132756 (CHEMBL4842271)
IC50
2390±n/a nM
Citation
 Nagy, MA; Hilgraf, R; Mortensen, DS; Elsner, J; Norris, S; Tikhe, J; Yoon, W; Paisner, D; Delgado, M; Erdman, P; Haelewyn, J; Khambatta, G; Xu, L; Romanow, WJ; Condroski, K; Bahmanyar, S; McCarrick, M; Benish, B; Blease, K; LeBrun, L; Moghaddam, MF; Apuy, J; Canan, SS; Bennett, BL; Satoh, Y Discovery of the c-Jun N-Terminal Kinase Inhibitor  J Med Chem 64:18193-18208 (2021) [PubMed]  Article 
Target
Name:
Mitogen-activated protein kinase 8
Synonyms:
Jnk1 | MAP kinase 8 | MAPK 8 | MK08_MOUSE | Mapk8 | Prkm8 | Stress-activated protein kinase JNK1 | c-Jun N-terminal kinase 1
Type:
PROTEIN
Mol. Mass.:
44234.80
Organism:
Mus musculus
Description:
ChEMBL_120521
Residue:
384
Sequence:
MSRSKRDNNFYSVEIGDSTFTVLKRYQNLKPIGSGAQGIVCAAYDAILERNVAIKKLSRPFQNQTHAKRAYRELVLMKCVNHKNIIGLLNVFTPQKSLEEFQDVYIVMELMDANLCQVIQMELDHERMSYLLYQMLCGIKHLHSAGIIHRDLKPSNIVVKSDCTLKILDFGLARTAGTSFMMTPYVVTRYYRAPEVILGMGYKENVDLWSVGCIMGEMVCHKILFPGRDYIDQWNKVIEQLGTPCPEFMKKLQPTVRTYVENRPKYAGYSFEKLFPDVLFPADSEHNKLKASQARDLLSKMLVIDASKRISVDEALQHPYINVWYDPSEAEAPPPKIPDKQLDEREHTIEEWKELIYKEVMDLEERTKNGVIRGQPSPLAQVQQ
  
Inhibitor
Name:
BDBM50578345
Synonyms:
CHEMBL4848290
Type:
Small organic molecule
Emp. Form.:
C15H25N5O2
Mol. Mass.:
307.3913
SMILES:
CO[C@H]1CC[C@@H](CC1)Nc1ncc(C(N)=O)c(NC(C)C)n1 |r,wU:5.8,wD:2.1,(3.78,-21.45,;5.12,-20.68,;6.45,-21.46,;6.44,-23,;7.78,-23.78,;9.1,-23.01,;9.11,-21.47,;7.79,-20.7,;10.44,-23.78,;11.77,-23.01,;11.77,-21.47,;13.1,-20.7,;14.44,-21.46,;15.77,-20.68,;17.1,-21.45,;15.76,-19.14,;14.45,-23,;15.78,-23.77,;15.79,-25.31,;17.13,-26.06,;14.46,-26.09,;13.1,-23.78,)|
Structure:
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