Molecular screening for potential selective antagonists of TRPA<sub>1</sub> ion channel
The article discusses the results of analysis a number of candidate molecules for TRPA1 ion channel selective antagonists using molecular modeling methods of high throughput screening. The study determined their mechanisms of action and specific activity in cells with overexpression of TRPA1 ion cha...
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| Format: | Article |
| Language: | Russian |
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Federal State Budgetary Institution ‘Scientific Centre for Expert Evaluation of Medicinal Products’ of the Ministry of Health of the Russian Federation (FSBI ‘SCEEMP’)
2018-02-01
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| Series: | Регуляторные исследования и экспертиза лекарственных средств |
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| Online Access: | https://www.vedomostincesmp.ru/jour/article/view/140 |
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| author | E. A. Beskhmelnitsyna D. V. Kravchenko M. V. Pokrovsky M. V. Korokin A. A. Peresypkina E. I. Varavin D. A. Kostina |
| author_facet | E. A. Beskhmelnitsyna D. V. Kravchenko M. V. Pokrovsky M. V. Korokin A. A. Peresypkina E. I. Varavin D. A. Kostina |
| author_sort | E. A. Beskhmelnitsyna |
| collection | DOAJ |
| description | The article discusses the results of analysis a number of candidate molecules for TRPA1 ion channel selective antagonists using molecular modeling methods of high throughput screening. The study determined their mechanisms of action and specific activity in cells with overexpression of TRPA1 ion channel. It demonstrated antagonistic activity of test substances in relation to TRPA1 ion channel based on the results of molecular screening of biologically active molecules and their comparison with the reference antagonist. The highest activity was demonstrated by the substance with the ZC02-0012 code which was regarded as the main candidate that could be recommended for use in further safety and selectivity studies using in vitro tests and subsequent in vivo experiments aimed at determining its activity and safety in relation to living systems. |
| first_indexed | 2024-03-07T19:18:08Z |
| format | Article |
| id | doaj.art-79de8f60e895454face3ae8ac3204ba4 |
| institution | Directory Open Access Journal |
| issn | 3034-3062 3034-3453 |
| language | Russian |
| last_indexed | 2025-03-14T10:56:56Z |
| publishDate | 2018-02-01 |
| publisher | Federal State Budgetary Institution ‘Scientific Centre for Expert Evaluation of Medicinal Products’ of the Ministry of Health of the Russian Federation (FSBI ‘SCEEMP’) |
| record_format | Article |
| series | Регуляторные исследования и экспертиза лекарственных средств |
| spelling | doaj.art-79de8f60e895454face3ae8ac3204ba42025-03-02T10:46:40ZrusFederal State Budgetary Institution ‘Scientific Centre for Expert Evaluation of Medicinal Products’ of the Ministry of Health of the Russian Federation (FSBI ‘SCEEMP’)Регуляторные исследования и экспертиза лекарственных средств3034-30623034-34532018-02-0173186189138Molecular screening for potential selective antagonists of TRPA<sub>1</sub> ion channelE. A. Beskhmelnitsyna0D. V. Kravchenko1M. V. Pokrovsky2M. V. Korokin3A. A. Peresypkina4E. I. Varavin5D. A. Kostina6Belgorod National Research UniversityChemical Diversity Research InstituteBelgorod National Research UniversityBelgorod National Research UniversityBelgorod National Research UniversityBelgorod National Research UniversityBelgorod National Research UniversityThe article discusses the results of analysis a number of candidate molecules for TRPA1 ion channel selective antagonists using molecular modeling methods of high throughput screening. The study determined their mechanisms of action and specific activity in cells with overexpression of TRPA1 ion channel. It demonstrated antagonistic activity of test substances in relation to TRPA1 ion channel based on the results of molecular screening of biologically active molecules and their comparison with the reference antagonist. The highest activity was demonstrated by the substance with the ZC02-0012 code which was regarded as the main candidate that could be recommended for use in further safety and selectivity studies using in vitro tests and subsequent in vivo experiments aimed at determining its activity and safety in relation to living systems.https://www.vedomostincesmp.ru/jour/article/view/140ионный канал trpa<sub>1</sub>больноцицепциявоспалениевысокопроизводительный молекулярный скринингмолекулы-кандидаты в селективные антагонисты ионного канала trpa<sub>1</sub>trpa<sub>1 </sub>ion channelpainnociceptioninflammationhigh throughput screeningcandidate molecules for selective antagonists of trpa<sub>1 </sub>ion channel |
| spellingShingle | E. A. Beskhmelnitsyna D. V. Kravchenko M. V. Pokrovsky M. V. Korokin A. A. Peresypkina E. I. Varavin D. A. Kostina Molecular screening for potential selective antagonists of TRPA<sub>1</sub> ion channel Регуляторные исследования и экспертиза лекарственных средств ионный канал trpa<sub>1</sub> боль ноцицепция воспаление высокопроизводительный молекулярный скрининг молекулы-кандидаты в селективные антагонисты ионного канала trpa<sub>1</sub> trpa<sub>1 </sub>ion channel pain nociception inflammation high throughput screening candidate molecules for selective antagonists of trpa<sub>1 </sub>ion channel |
| title | Molecular screening for potential selective antagonists of TRPA<sub>1</sub> ion channel |
| title_full | Molecular screening for potential selective antagonists of TRPA<sub>1</sub> ion channel |
| title_fullStr | Molecular screening for potential selective antagonists of TRPA<sub>1</sub> ion channel |
| title_full_unstemmed | Molecular screening for potential selective antagonists of TRPA<sub>1</sub> ion channel |
| title_short | Molecular screening for potential selective antagonists of TRPA<sub>1</sub> ion channel |
| title_sort | molecular screening for potential selective antagonists of trpa sub 1 sub ion channel |
| topic | ионный канал trpa<sub>1</sub> боль ноцицепция воспаление высокопроизводительный молекулярный скрининг молекулы-кандидаты в селективные антагонисты ионного канала trpa<sub>1</sub> trpa<sub>1 </sub>ion channel pain nociception inflammation high throughput screening candidate molecules for selective antagonists of trpa<sub>1 </sub>ion channel |
| url | https://www.vedomostincesmp.ru/jour/article/view/140 |
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