Literature DB >> 15715498

CH...O and CH...N hydrogen bonds in ligand design: a novel quinazolin-4-ylthiazol-2-ylamine protein kinase inhibitor.

Albert C Pierce1, Ernst ter Haar, Hayley M Binch, David P Kay, Sanjay R Patel, Pan Li.   

Abstract

Aryl CH hydrogen bonds play an important role in the binding of several analogues of a pyrazol-3-ylquinazolin-4-ylamine inhibitor of glycogen synthase kinase 3 (GSK3). Understanding the importance of these CH...O and CH...N hydrogen bonds allowed the design of a novel quinazolin-4-ylthiazol-2-ylamine inhibitor of GSK3 with a structurally confirmed CH...O hydrogen bond to the protein.

Entities:  

Mesh:

Substances:

Year:  2005        PMID: 15715498     DOI: 10.1021/jm0492249

Source DB:  PubMed          Journal:  J Med Chem        ISSN: 0022-2623            Impact factor:   7.446


  5 in total

1.  Molecular mechanism of serotonin transporter inhibition elucidated by a new flexible docking protocol.

Authors:  Mari Gabrielsen; Rafał Kurczab; Aina W Ravna; Irina Kufareva; Ruben Abagyan; Zdzisław Chilmonczyk; Andrzej J Bojarski; Ingebrigt Sylte
Journal:  Eur J Med Chem       Date:  2011-10-20       Impact factor: 6.514

2.  Discovery of 4-Piperazine Isoquinoline Derivatives as Potent and Brain-Permeable Tau Prion Inhibitors with CDK8 Activity.

Authors:  Jean-Marc M Grandjean; Alexander Y Jiu; John W West; Atsushi Aoyagi; Daniel G Droege; Manuel Elepano; Makoto Hirasawa; Masakazu Hirouchi; Ryo Murakami; Joanne Lee; Koji Sasaki; Shimpei Hirano; Takao Ohyama; Benjamin C Tang; Roy J Vaz; Masahiro Inoue; Steven H Olson; Stanley B Prusiner; Jay Conrad; Nick A Paras
Journal:  ACS Med Chem Lett       Date:  2020-01-30       Impact factor: 4.345

Review 3.  A medicinal chemist's guide to molecular interactions.

Authors:  Caterina Bissantz; Bernd Kuhn; Martin Stahl
Journal:  J Med Chem       Date:  2010-07-22       Impact factor: 7.446

4.  Effect of NS-018, a selective JAK2V617F inhibitor, in a murine model of myelofibrosis.

Authors:  Y Nakaya; K Shide; H Naito; T Niwa; T Horio; J Miyake; K Shimoda
Journal:  Blood Cancer J       Date:  2014-01-10       Impact factor: 11.037

5.  Decreased store operated Ca2+ entry in dendritic cells isolated from mice expressing PKB/SGK-resistant GSK3.

Authors:  Evi Schmid; Jing Yan; Meerim K Nurbaeva; Antonella Russo; Wenting Yang; Caterina Faggio; Ekaterina Shumilina; Florian Lang
Journal:  PLoS One       Date:  2014-02-11       Impact factor: 3.240

  5 in total

北京卡尤迪生物科技股份有限公司 © 2022-2023.