Literature DB >> 20621725

Structure-based optimization of potent PDK1 inhibitors.

Mauro Angiolini1, Patrizia Banfi, Elena Casale, Francesco Casuscelli, Claudio Fiorelli, Maria B Saccardo, Marco Silvagni, Fabio Zuccotto.   

Abstract

In this Letter is described the structure-based design of potent dihydro-pyrazoloquinazolines as PDK1 inhibitors. Starting from low potency HTS hits with the aid of X-ray crystallography and modeling, a medicinal chemistry activity was carried out to improve potency versus PDK1 and selectivity versus CDK2 protein kinase. 2010 Elsevier Ltd. All rights reserved.

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Year:  2010        PMID： 20621725     DOI： 10.1016/j.bmcl.2010.05.070

Source DB:  PubMed          Journal:  Bioorg Med Chem Lett        ISSN： 0960-894X            Impact factor:   2.823


  5 in total

1.  In silico fragment-mapping method: a new tool for fragment-based/structure-based drug discovery.

Authors:  Noriyuki Yamaotsu; Shuichi Hirono
Journal:  J Comput Aided Mol Des       Date:  2018-09-08       Impact factor: 3.686

2.  Inhibition of HIV-1 Tat-mediated transcription by a coumarin derivative, BPRHIV001, through the Akt pathway.

Authors:  Pi-Han Lin; Yi-Yu Ke; Chun-Ting Su; Hui-Yi Shiao; Hsing-Pang Hsieh; Yu-Kai Chao; Chun-Nan Lee; Chuan-Liang Kao; Yu-Sheng Chao; Sui-Yuan Chang
Journal:  J Virol       Date:  2011-06-22       Impact factor: 5.103

3.  Novel isoquinolone PDK1 inhibitors discovered through fragment-based lead discovery.

Authors:  M Catherine Johnson; Qiyue Hu; Laura Lingardo; Rose Ann Ferre; Samantha Greasley; Jiangli Yan; John Kath; Ping Chen; Jacques Ermolieff; Gordon Alton
Journal:  J Comput Aided Mol Des       Date:  2011-07-22       Impact factor: 3.686

4.  Design, Synthesis and Biological Activity Evaluation of S-Substituted 1H-5-Mercapto-1,2,4-Triazole Derivatives as Antiproliferative Agents in Colorectal Cancer.

Authors:  Marius Mioc; Sorin Avram; Vasile Bercean; Ludovic Kurunczi; Roxana M Ghiulai; Camelia Oprean; Dorina E Coricovac; Cristina Dehelean; Alexandra Mioc; Mihaela Balan-Porcarasu; Calin Tatu; Codruta Soica
Journal:  Front Chem       Date:  2018-08-23       Impact factor: 5.221

Review 5.  The chemical diversity and structure-based discovery of allosteric modulators for the PIF-pocket of protein kinase PDK1.

Authors:  Xinyuan Xu; Yingyi Chen; Qiang Fu; Duan Ni; Jian Zhang; Xiaolong Li; Shaoyong Lu
Journal:  J Enzyme Inhib Med Chem       Date:  2019-12       Impact factor: 5.051
  5 in total

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