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TitleDesign and synthesis of a novel, orally active, brain penetrant, tri-substituted thiophene based JNK inhibitor.
Journal, issue, pagesBioorg. Med. Chem. Lett., Vol. 21, Page 1838-1843, Year 2011
Publish dateDec 2, 2010 (structure data deposition date)
AuthorsBowers, S. / Truong, A.P. / Neitz, R.J. / Neitzel, M. / Probst, G.D. / Hom, R.K. / Peterson, B. / Galemmo, R.A. / Konradi, A.W. / Sham, H.L. ...Bowers, S. / Truong, A.P. / Neitz, R.J. / Neitzel, M. / Probst, G.D. / Hom, R.K. / Peterson, B. / Galemmo, R.A. / Konradi, A.W. / Sham, H.L. / Toth, G. / Pan, H. / Yao, N. / Artis, D.R. / Brigham, E.F. / Quinn, K.P. / Sauer, J.M. / Powell, K. / Ruslim, L. / Ren, Z. / Bard, F. / Yednock, T.A. / Griswold-Prenner, I.
External linksBioorg. Med. Chem. Lett. / PubMed:21316234
MethodsX-ray diffraction
Resolution2.43 Å
Structure data

PDB-3ptg:
Design and Synthesis of a Novel, Orally Efficacious Tri-substituted Thiophene Based JNK Inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2.43 Å

Chemicals

ChemComp-932:
N-[4-methyl-3-(1H-1,2,4-triazol-5-yl)thiophen-2-yl]-2-(2-oxo-3,4-dihydroquinolin-1(2H)-yl)acetamide

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsTRANSFERASE/TRANSFERASE INHIBITOR / JNK Inhibitor / Thiophene / neurodegeneration / TRANSFERASE-TRANSFERASE INHIBITOR complex

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