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TitleIdentification of a new class of potent Cdc7 inhibitors designed by putative pharmacophore model: Synthesis and biological evaluation of 2,3-dihydrothieno[3,2-d]pyrimidin-4(1H)-ones.
Journal, issue, pagesBioorg. Med. Chem., Vol. 25, Page 2133-2147, Year 2017
Publish dateDec 12, 2016 (structure data deposition date)
AuthorsKurasawa, O. / Oguro, Y. / Miyazaki, T. / Homma, M. / Mori, K. / Iwai, K. / Hara, H. / Skene, R. / Hoffman, I. / Ohashi, A. ...Kurasawa, O. / Oguro, Y. / Miyazaki, T. / Homma, M. / Mori, K. / Iwai, K. / Hara, H. / Skene, R. / Hoffman, I. / Ohashi, A. / Yoshida, S. / Ishikawa, T. / Cho, N.
External linksBioorg. Med. Chem. / PubMed:28284870
MethodsX-ray diffraction
Resolution3.15 - 3.33 Å
Structure data

PDB-5u7q:
Identification of A New Class of Potent Cdc7 Inhibitors Designed by Putative Pharmacophore Model: Synthesis and Biological Evaluation of 2,3-Dihydrothieno[3,2-d]pyrimidin-4(1H)-ones
Method: X-RAY DIFFRACTION / Resolution: 3.15 Å

PDB-5u7r:
Identification of A New Class of Potent Cdc7 Inhibitors Designed by Putative Pharmacophore Model: Synthesis and Biological Evaluation of 2,3-Dihydrothieno[3,2-d]pyrimidin-4(1H)-ones
Method: X-RAY DIFFRACTION / Resolution: 3.33 Å

Chemicals

ChemComp-HOH:
WATER

ChemComp-81G:
(1s,4s)-4-(4-fluorophenyl)-4-hydroxy-6'-(5-methyl-1H-pyrazol-4-yl)-1'H-spiro[cyclohexane-1,2'-thieno[3,2-d]pyrimidin]-4'(3'H)-one

Source
  • homo sapiens (human)
KeywordsTRANSFERASE / Serine/threonine kinase / apo-protein

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