3D-QSAR studies and molecular design on a novel series of pyrimidine benzimidazoles as Lck inhibitors-Reference-Cited by-同舟云学术

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3D-QSAR studies and molecular design on a novel series of pyrimidine benzimidazoles as Lck inhibitors

Published:2014-02-26 Issue:9 Volume:114 Page:598-609
ISSN:0020-7608
Container-title:International Journal of Quantum Chemistry
language:en
Short-container-title:Int. J. Quantum Chem.

Author:

Xie Wen Guo¹,Fang Dan Qing²,Wu Wen Juan¹,Zhang Rong¹,Zeng Guo Hua¹,Ma Shao Jie¹,Wu Jing Heng³,Shen Yong³

Affiliation:

1. Laboratory of Physical Chemistry, College of Pharmacy; Guangdong Pharmaceutical University; Guangzhou 510006 China

2. Department of Cardiothoracic Surgery; Second Affiliated Hospital of Guangzhou Medical College; Guangzhou 510260 China

3. School of Chemistry and Chemical Engineering; Sun Yat-Sen University; Guangzhou 510275 China

Funder

National Natural Science Foundation of China

Natural Science Foundation of Guangdong

Science and Technology Planning Project of Guangzhou

Publisher

Wiley

Subject

Physical and Theoretical Chemistry,Condensed Matter Physics,Atomic and Molecular Physics, and Optics

Link

http://onlinelibrary.wiley.com/wol1/doi/10.1002/qua.24645/fullpdf

Reference40 articles.

1. Genetic evidence for the involvement of the lck tyrosine kinase in signal transduction through the T cell antigen receptor

2. Function of the Src-family kinases, Lck and Fyn, in T-cell development and activation

3. Lck regulates the tyrosine phosphorylation of the T cell receptor subunits and ZAP-70 in murine thymocytes.

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1. Insight View on Synthetic Strategies and Biological Applications of Pyrimidobenzothiazoles;Mini-Reviews in Organic Chemistry;2021-12

2. 3D-QSAR and molecular docking studies of aminopyrimidine derivatives as novel three-targeted Lck/Src/KDR inhibitors;Journal of Molecular Structure;2019-06

3. Molecular design of 1,3,5,7-TetraCN derivatives with reduced bioconcentration using 3D-QSAR modeling, full factorial design, and molecular docking;Journal of Molecular Graphics and Modelling;2018-09

4. Investigating the binding mechanism of novel 6-aminonicotinate-based antagonists with P2Y12 by 3D-QSAR, docking and molecular dynamics simulations;Journal of Biomolecular Structure and Dynamics;2016-09-30

5. Development of Structure Activity Correlation Model on Azetidin-2-ones as Tubulin Polymerization Inhibitors;Letters in Drug Design & Discovery;2015-03-24

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