Pyrazolopyrimidines as anticancer agents: A review on structural and target-based approaches.
Sign Up to like & getrecommendations! Published in 2021 at "European journal of medicinal chemistry"
DOI: 10.1016/j.ejmech.2021.113781
Abstract: Pyrazolopyrimidine scaffold is one of the privileged heterocycles in drug discovery. This scaffold produced numerous biological activities in which anticancer is important one. Previous studies showed its importance in interactions with various receptors such as… read more here.
Keywords: target based; anticancer agents; pyrazolopyrimidines anticancer; kinase ... See more keywords
Embedded atom potential for Sm–Co compounds obtained by force-matching
Sign Up to like & getrecommendations! Published in 2019 at "Journal of Magnetism and Magnetic Materials"
DOI: 10.1016/j.jmmm.2019.165468
Abstract: Abstract We present the results of ab initio simulations of the series of intermetallic Sm–Co compounds. We show that the “open core” approach allows calculating intrinsic properties of Sm–Co compounds with sufficient accuracy for all… read more here.
Keywords: atom potential; obtained force; embedded atom; potential compounds ... See more keywords
Molecular docking and molecular dynamics approach to identify potential compounds in Huperzia squarrosa for treating Alzheimer’s disease
Sign Up to like & getrecommendations! Published in 2022 at "Journal of Complementary and Integrative Medicine"
DOI: 10.1515/jcim-2021-0462
Abstract: Abstract Objectives Alzheimer’s disease (AD) is a lingering progressive neurodegenerative disorder that causes patients to lose cognitive function. The enzyme Acetylcholinesterase (AChE), Butyrylcholinesterase (BuChE), Monoamine oxidase A (MAO A), Beta-secretase cleavage enzyme (BACE 1) and… read more here.
Keywords: molecular docking; huperzia squarrosa; alzheimer disease; molecular dynamics ... See more keywords
Therapeutic potential of compounds targeting SARS-CoV-2 helicase
Sign Up to like & getrecommendations! Published in 2022 at "Frontiers in Chemistry"
DOI: 10.3389/fchem.2022.1062352
Abstract: The economical and societal impact of COVID-19 has made the development of vaccines and drugs to combat SARS-CoV-2 infection a priority. While the SARS-CoV-2 spike protein has been widely explored as a drug target, the… read more here.
Keywords: therapeutic potential; compounds targeting; cov helicase; helicase ... See more keywords
Potential of the Compounds from Bixa orellana Purified Annatto Oil and Its Granules (Chronic®) against Dyslipidemia and Inflammatory Diseases: In Silico Studies with Geranylgeraniol and Tocotrienols
Sign Up to like & getrecommendations! Published in 2022 at "Molecules"
DOI: 10.3390/molecules27051584
Abstract: Some significant compounds present in annatto are geranylgeraniol and tocotrienols. These compounds have beneficial effects against hyperlipidemia and chronic diseases, where oxidative stress and inflammation are present, but the exact mechanism of action of such… read more here.
Keywords: compounds bixa; action; geranylgeraniol tocotrienols; inflammatory ... See more keywords