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Chemoreactome analysis of 7-hydroxymatairesinol, 17-estradiol, phytoestrogen β-sitosterol and epigallocatechin-3-gallate

https://doi.org/10.17749/2313-7347/ob.gyn.rep.2020.152

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Abstract

The results of the evaluation of 7-hydroximatairesinol (7-HMR) properties in comparison with control molecules (17-estradiol, phytoestrogen β-sytostirol, epigallocatechin-3-gallate) are presented. The results of chemoreactomic modeling allowed to formulate the molecular mechanisms of 7-HMR pharmacological effects for anti-inflammatory (inhibition of 5-lipoxygenase, matrix metalloproteinase MMR2, mitogen-activated kinase p38-alpha, leukotriene-b4 receptor, prostacyclin receptor), antitumor (antioxidant effect due to inhibition of hemoxygenase-2, inhibition of cyclin dependent kinases 3 and 4, epidermis growth factor, protein mTOR), vasodilator (inhibition of adrenoreceptors and renin), antibacterial and antiviral (inhibition of viral proteases 3C) properties of 7-HMR molecule.

About the Authors

I. Yu. Torshin
Institute of Pharmacoinformatics, Federal Research Center «Informatics and Management», Russian Academy of Sciences; Big Data Storage and Analysis Center, Lomonosov Moscow State University
Russian Federation

Ivan Yu. Torshin – PhD (Chemistry), PhD in Applied Mathematics, Senior Researcher; Senior Researcher, Big Data Storage and Analysis Center
Scopus Author ID: 7003300274. Researcher ID: C-7683-2018. Author ID: 54104. WOS ID: C-7683-2018.

42 Vavilova Str., Moscow 119333;
1 Leninskie gory, Moscow 119234



A. N. Rubashkina
Ivanovo State Medical Academy, Health Ministry of Russian Federation
Russian Federation

Anna N. Rubashkina – MD, Postgraduate Student, Department of Oncology, Obstetrics and Gynecology

8 Sheremetyevskiy Ave., Ivanovo 153012



N. P. Lapochkina
Ivanovo State Medical Academy, Health Ministry of Russian Federation
Russian Federation

Nina P. Lapochkina – МD, Dr Sci Med, Associate Professor, Department of Oncology, Obstetrics and Gynecology

8 Sheremetyevskiy Ave., Ivanovo 153012



O. A. Gromova
Institute of Pharmacoinformatics, Federal Research Center «Informatics and Management», Russian Academy of Sciences; Big Data Storage and Analysis Center, Lomonosov Moscow State University
Russian Federation

Olga A. Gromova – MD, Dr Sci Med, Professor, Leading Researcher, Scientific Director; Leading Researcher, Big Data Storage and Analysis Center
Scopus Author ID: 7003589812. Researcher ID: J-4946-2017. Author ID: 94901. WOS ID: J-4946-2017.

42 Vavilova Str., Moscow 119333;
1 Leninskie gory, Moscow 119234



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For citation:


Torshin I.Yu., Rubashkina A.N., Lapochkina N.P., Gromova O.A. Chemoreactome analysis of 7-hydroxymatairesinol, 17-estradiol, phytoestrogen β-sitosterol and epigallocatechin-3-gallate. Obstetrics, Gynecology and Reproduction. 0;. (In Russ.) https://doi.org/10.17749/2313-7347/ob.gyn.rep.2020.152

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ISSN 2313-7347 (Print)
ISSN 2500-3194 (Online)