Identifying plant-derived antiviral alkaloids as dual inhibitors of SARS-CoV-2 main protease and spike glycoprotein through computational screening
COVID-19 is currently considered the ninth-deadliest pandemic, spreading through direct or
indirect contact with infected individuals. It has imposed a consistent strain on both the …
indirect contact with infected individuals. It has imposed a consistent strain on both the …
Theoretical insights into the anti-SARS-CoV-2 activity of chloroquine and its analogs and in silico screening of main protease inhibitors
AS Achutha, VL Pushpa, S Suchitra - Journal of proteome …, 2020 - ACS Publications
Corona virus disease (COVID-19) is a dangerous disease rapidly spreading all over the
world today. Currently there are no treatment options for it. Drug repurposing studies …
world today. Currently there are no treatment options for it. Drug repurposing studies …
Newly synthesised oxime and lactone derivatives from Dipterocarpus alatus dipterocarpol as anti-diabetic inhibitors: experimental bioassay-based evidence and …
Dipterocarpus alatus-derived products are expected to exhibit anti-diabetes properties.
Natural dipterocarpol (1) was isolated from Dipterocarpus alatus collected in Quang Nam …
Natural dipterocarpol (1) was isolated from Dipterocarpus alatus collected in Quang Nam …
Computational investigation of novel farnesyltransferase inhibitors using 3D-QSAR pharmacophore modeling, virtual screening, molecular docking and molecular …
Farnesyltransferase (FTase) is considered as an effective target in treating a variety of
cancers. In this investigation, a 3D-QSAR pharmacophore search was performed to identify …
cancers. In this investigation, a 3D-QSAR pharmacophore search was performed to identify …
In Silico Approaches for Investigating the Binding Propensity of Apigenin and Luteolin Against Class I HDAC Isoforms
Aim: Aberrant activity of class I histone deacetylases (HDACs) has strong implications for
various cancers. Targeting these HDACs with synthetic HDAC inhibitors has shown …
various cancers. Targeting these HDACs with synthetic HDAC inhibitors has shown …
Targeting lon protease to inhibit persister cell formation in Salmonella Typhimurium: a drug repositioning approach
Objective Persister cells are a specific subset of bacteria capable of surviving exposure to
lethal doses of antibiotics, leading to antibiotic therapy failures and infection relapses. This …
lethal doses of antibiotics, leading to antibiotic therapy failures and infection relapses. This …
[HTML][HTML] Repurposing FDA-approved drugs cetilistat, abiraterone, diiodohydroxyquinoline, bexarotene, and Remdesivir as potential inhibitors against RNA dependent …
Vaccines are undoubtedly the most effective means of combating viral diseases like COVID-
19. However, there are risks associated with vaccination, such as incomplete viral …
19. However, there are risks associated with vaccination, such as incomplete viral …
[HTML][HTML] Can polyoxometalates (POMs) prevent of coronavirus 2019-nCoV cell entry? Interaction of POMs with TMPRSS2 and spike receptor domain complexed with …
The unexpected appearance and global spread of COVID-19 create significant difficulties for
healthcare systems and present an unusual challenge for the fast discovery of medicines to …
healthcare systems and present an unusual challenge for the fast discovery of medicines to …
The potential mechanism of Bupleurum against anxiety was predicted by network pharmacology study and molecular docking
HB Wu, YG **ao, JS Chen, ZK Qiu - Metabolic Brain Disease, 2022 - Springer
Bupleurum chinense DC.(Chaihu) is a traditional Chinese medicine (TCM) used in the
treatment of anxiety. But the anxiolytic mechanisms of bupleurum are still unclear. Therefore …
treatment of anxiety. But the anxiolytic mechanisms of bupleurum are still unclear. Therefore …
Curcumin analogs as anti-cathepsins agents: Designing, virtual screening, and molecular docking analysis
Anti-cathepsin B agents can be potential drug candidates in the prevention and cure of
Alzheimer's disease. The enzyme has been found to be involved in amyloid-β, accumulation …
Alzheimer's disease. The enzyme has been found to be involved in amyloid-β, accumulation …