Network pharmacology prediction and molecular docking-based strategy to explore the potential mechanism of Huanglian Jiedu Decoction against sepsis

X Li, S Wei, S Niu, X Ma, H Li, M **g, Y Zhao - Computers in biology and …, 2022 - Elsevier
Abstract Background Huanglian Jiedu Decoction (HLJDD) is a classical herbal formula with
potential efficacy in the treatment of sepsis. However, the main components and potential …

Modern approaches in the discovery and development of plant-based natural products and their analogues as potential therapeutic agents

A Najmi, SA Javed, M Al Bratty, HA Alhazmi - Molecules, 2022 - mdpi.com
Natural products represents an important source of new lead compounds in drug discovery
research. Several drugs currently used as therapeutic agents have been developed from …

A Comprehensive Review on Cannabis sativa Ethnobotany, Phytochemistry, Molecular Docking and Biological Activities

S Hourfane, H Mechqoq, AY Bekkali, JM Rocha… - Plants, 2023 - mdpi.com
For more than a century, Cannabis was considered a narcotic and has been banned by
lawmakers all over the world. In recent years, interest in this plant has increased due to its …

[HTML][HTML] The role and potential of computer-aided drug discovery strategies in the discovery of novel antimicrobials

SO Oselusi, P Dube, AI Odugbemi, KA Akinyede… - Computers in biology …, 2024 - Elsevier
Antimicrobial resistance (AMR) has become more of a concern in recent decades,
particularly in infections associated with global public health threats. The development of …

Using Network Pharmacology and Molecular Docking to Explore the Mechanism of Shan Ci Gu (Cremastra appendiculata) Against Non-Small Cell Lung Cancer

Y Wang, Y Zhang, Y Wang, X Shu, C Lu, S Shao… - Frontiers in …, 2021 - frontiersin.org
Background: In recent years, the incidence and mortality rates of non-small cell lung cancer
(NSCLC) have increased significantly. Shan Ci Gu is commonly used as an anticancer drug …

Immune-Enhancing Effects of a Novel Glucan from Purple Sweet Potato Ipomoea batatas (L.) Lam on RAW264.7 Macrophage Cells via TLR2- and TLR4-Mediated …

C Ji, Z Zhang, J Chen, D Song, B Liu, J Li… - Journal of Agricultural …, 2021 - ACS Publications
PSPP-1 was obtained from purple sweet potato, and the effects of PSPP-1 on the immune
modulation on macrophage cells were investigated for the first time. PSPP-1 promoted …

[PDF][PDF] Natural Products As Sources of Drug Discovery: Exploration, Optimisation, and Translation Into Clinical Practice

S Mandal, NR Kar, AV Jain, P Yadav - African J Biol Sci (South Africa), 2024 - afjbs.com
This paper features the significance of regular items in drug disclosure, featuring their
assorted synthetic designs and natural exercises. It underscores the requirement for a …

Synthesis of thiazolidine-2, 4-dione tethered 1, 2, 3-triazoles as α-amylase inhibitors: in vitro approach coupled with QSAR, molecular docking, molecular dynamics …

R Singh, J Sindhu, M Devi, P Kumar, S Lal… - European Journal of …, 2024 - Elsevier
A new series of thiazolidine-2, 4-dione tethered 1, 2, 3-triazole derivatives were designed,
synthesized and screened for their α-amylase inhibitory potential employing in vitro and in …

[HTML][HTML] Production of fucoxanthin from microalgae Isochrysis galbana of Djibouti: Optimization, correlation with antioxidant potential, and bioinformatics approaches

F Mohamed Abdoul-Latif, A Ainane, L Achenani… - Marine Drugs, 2024 - mdpi.com
Fucoxanthin, a carotenoid with remarkable antioxidant properties, has considerable
potential for high-value biotechnological applications in the pharmaceutical, nutraceutical …

Applying molecular docking to pesticides

Y Hou, Y Bai, C Lu, Q Wang, Z Wang… - Pest Management …, 2023 - Wiley Online Library
Pesticide creation is related to the development of sustainable agricultural and ecological
safety, and molecular docking technology can effectively help in pesticide innovation. This …