Synthesis, biological evaluation, molecular modeling, and structural analysis of new pyrazole and pyrazolone derivatives as N-formyl peptide receptors agonists; Chemical Biology and Drug Design; Vol. 98, iss. 4

Synthesis, biological evaluation, molecular modeling, and structural analysis of new pyrazole and pyrazolone derivatives as N-formyl peptide receptors agonists; Chemical Biology and Drug Design; Vol. 98, iss. 4

Bibliografske podrobnosti
Parent link:Chemical Biology and Drug Design
Vol. 98, iss. 4.— 2021.— [P. 582-603]
Korporativna značnica: Национальный исследовательский Томский политехнический университет Инженерная школа новых производственных технологий Научно-образовательный центр Н. М. Кижнера
Drugi avtorji: Vergelli C. Claudia, Khlebnikov A. I. Andrey Ivanovich, Crocetti L. Letizia, Guerrini G. Gabriella, Cantini N. Niccolo, Kirpotina L. N. Liliya Nikolaevna, Shchepyotkin I. A. Igor Aleksandrovich, Cilibrizzi A. Agostino, Quinn M. T. Mark, Rossi P. Patrizia, Paoli P. Paola, Giovannoni M. P. Maria Paola
Izvleček:Title screen
N-formyl peptide receptors (FPR1, FPR2, and FPR3) play key roles in the regulation of inflammatory processes, and recently, it was demonstrated that FPR1 and FPR2 have a dual role in the progression/suppression of some cancers. Therefore, FPRs represent an important therapeutic target for the treatment of both cancer and inflammatory diseases. Previously, we identified selective or mixed FPR agonists with pyridazinone or pyridinone scaffolds showing a common 4-(bromophenyl)acetamide fragment, which was essential for activity. We report here new pyrazole and pyrazolone derivatives as restricted analogues of the above 6-membered compounds, all exhibiting the same 4-bromophenylacetamide side chain. Most new products had low or absent FPR agonist activity, suggesting that the pyrazole nucleus was not appropriate for FPR agonists. This hypothesis was confirmed by molecular modeling studies, which highlighted that the five-membered scaffold was responsible for a worse arrangement of the molecules in the receptor binding site.
Jezik:angleščina
Izdano: 2021
Teme:
электронный ресурс
труды учёных ТПУ
agonist
cancer
formyl peptide receptor
inflammation
neutrophil
pyrazole
pyrazolone
агонист
рак
нейтрофилы
пиразолы
пиразолон
воспалительные процессы
молекулярное моделирование
Online dostop:https://doi.org/10.1111/cbdd.13913
Format: Elektronski Book Chapter
KOHA link:https://koha.lib.tpu.ru/cgi-bin/koha/opac-detail.pl?biblionumber=666452

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