Реєстраційний номер
2114U008822, Матеріали видань та локальних репозитаріїв
Категорія
Текст
Назва роботи
Virtual Screening and its Experimental Validation Reveal Novel Compounds with Promising Anticancer Activity Among 4-Thiazolidinone- Pyrazoline- and Isatin-Based Conjugates
Автор
Девіняк Олег Теодозійович
Гаврилюк Дмитро Ярославович
Авдєєв Станіслав Сергійович
Чумак Віра Василівна
Панчук Ростислав Русланович
Стойка Ростислав Степанович
Кавсан Вадим Мусійович
Лесик Роман Богданович
Devinyak Oleh Teodoziiovych
Havryliuk Dmytro Yaroslavovych
Avdieiev Stanislav Serhiiovych
Chumak Vira Vasylivna
Panchuk Rostyslav Ruslanovych
Stoika Rostyslav Stepanovych
Kavsan Vadym Musiiovych
Lesyk Roman Bohdanovych
Дата публікації
01-01-2014
Постачальник інформації
Ужгородський національний університет
Першоджерело
https://dspace.uzhnu.edu.ua/jspui/handle/lib/3888
Видання
Austin Journal of Bioorganic & Organic Chemistry
Опис
In silico screening of virtual 4-thiazolidinones library has been carried out with several self-developed QSAR and pharmacophore models of anticancer activity. Such approach has allowed us to choose 14 the most probable anticancer hits - conjugates of 4-thiazolidinone, pyrazoline and isatin, which in turn have been
synthesized. Half of these compounds were subjected to anticancer activity evaluation and biological experiments confirmed our predictions, although in a qualitative manner. The most sensitive to tested compounds cancer cell line is Mino (the lowest IC50 reached 0.17 μM), which represents mantle cell lymphoma – a rare but very aggressive tumor. That identifies the further direction of biological studies of the novel anticancer hit compounds.
Додано/оновлено в НРАТ
2026-06-13
