Combined pharmacophore-guided 3D-QSAR, molecular docking and molecular dynamics studies for evodiamine analogs as DNA topoisomerase I inhibitors

Author:

Feng Kairui,Ren Yujie,Li Ren

Funder

Science and Technology Commission of Shanghai Municipality

Publisher

Elsevier BV

Subject

General Chemical Engineering,General Chemistry

Reference32 articles.

1. Identification of mammalian DNA topoisomerase I as an intracellular target of the anticancer drug camptothecin;Hsiang;Cancer Res,1988

2. Computational study of anticancer drug resistance caused by 10 topisomerase I mutations, including 7 camptothecin analogs and lucanthone;Mulholland;J Chem Inf Model,2016

3. Alcohol-, diol-, and carbohydrate-substituted indenoisoquinolines as topoisomerase I inhibitors: investigating the relationships involving stereochemistry, hydrogen bonding, and biological activity;Peterson;J Med Chem,2011

4. The indenoisoquinoline noncamptothecin topoisomerase I inhibitors: update and perspectives;Pommier;Mol Cancer Ther,2009

5. Topoisomerase degradation, DSB repair, p53 and IAPs in cancer cell resistance to camptothecin-like topoisomerase I inhibitors;Tomicic;BBA-Rev Cancer,2013

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