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Fragment-Based Discovery of 5-Arylisatin-Based Inhibitors of Matrix Metalloproteinases 2 and 13статья
Информация о цитировании статьи получена из
Web of Science,
Scopus
Статья опубликована в журнале из списка Web of Science и/или Scopus
Дата последнего поиска статьи во внешних источниках: 12 июля 2019 г.
- Авторы: Mariangela Agamennone, Belov Dmitry S., Antonio Laghezza, Ivanov Vladimir N., Novoselov Anton M., Andreev Ivan A., Ratmanova Nina K., Andrea Altieri, Paolo Tortorella, Kurkin Alexander V.
- Журнал: ChemMedChem
- Том: 11
- Номер: 17
- Год издания: 2016
- Издательство: Wiley - V C H Verlag GmbbH & Co.
- Местоположение издательства: Germany
- Первая страница: 1892
- Последняя страница: 1898
- DOI: 10.1002/cmdc.201600266
- Аннотация: Matrix metalloproteinases (MMPs) are well-established targets for several pathologies. In particular, MMP-2 and MMP-13 play a prominent role in cancer progression. In this study, a structure- based screening campaign was applied to prioritize metalloproteinase- oriented fragments. This computational model was applied to a representative fragment set from the publically available EDASA Scientific compound library. These fragments were prioritized, and the top-ranking hits were tested in a biological assay to validate the model. Two scaffolds showed consistent activity in the assay, and the isatin-based compounds were the most interesting. These latter fragments have significant potential as tools for the design and realization of novel MMP inhibitors. In addition to their micromolar activity, the chemical synthesis affords flexible and creative access to their analogues.
- Добавил в систему: Ратманова Нина Константиновна