Alzheimer’s disease poses a global health concern with unmet demand requiring creative approaches to discover new medications. In this study, we investigated the chemical composition and the anticholinesterase activity of Aspergillus niveus Fv-er401 isolated from Foeniculum vulgare (Apiaceae) roots. Fifty-eight metabolites were identified using UHPLC-MS/MS analysis of the crude extract. The fungal extract showed acetylcholinesterase (AChE) and butyrylcholinesterase (BuChE) inhibitory effects with IC₅₀ 53.44 ± 1.57 and 48.46 ± 0.41 µg/mL, respectively. Two known metabolites were isolated, terrequinone A and citrinin, showing moderate AChE and BuChE inhibitory activity using the Ellman’s method (IC₅₀ = 11.10 ± 0.38 µg/mL and 5.06 ± 0.15 µg/mL, respectively for AChE, and IC₅₀ 15.63 ± 1.27 µg/mL and 8.02 ± 0.08 µg/mL, respectively for BuChE). As evidenced by molecular docking, the isolated compounds and other structurally related metabolites identified by molecular networking had the required structural features for AChE and BuChE inhibition. Where varioxiranol G (−9.76 and −10.36 kcal/mol), penicitrinol B (−9.50 and −8.02 kcal/mol), dicitrinol A (−8.53 and −7.98 kcal/mol) and asterriquinone CT5 (−8.02 and −8.25 kcal/mol) showed better binding scores as AChE and BuChE inhibitors than the co-crystallized inhibitor (between −7.89 and 7.82 kcal/mol) making them promising candidates for the development of new drugs to treat Alzheimer’s.

Background: Sesbania sesban (L.) Merr. (Family: Fabaceae), commonly known as Egyptian riverhemp, is a well-known plant widely distributed through Egypt, the rest of Africa and Asia. S. sesban leaves have been traditionally used as an anthelmintic, demulcent, purgative, and anti-inflammatory agent in the treatment of eczema, in addition to its agricultural uses. Objective: The aim of this review is to present a comprehensive account of the isolated constituents from S. sesban leaves, along with the correlation between those constituents and the reported biological activities. Methods: This search was performed using SciFinder, Google, Google Scholar, and CrossRef websites using the following keywords: “ Sesbania sesban,” “ Sesbania aegyptiaca,” “Egyptian riverhemp,” “phytochemistry,” “phytochemical constituents,” “isolation,” “steroids,” “triterpenoids,” “saponins,” “coumarins,” “lipoidal contents,” “pharmacological properties,” “biological activities,” “therapeutic uses,” and “review.” Results: S. sesban leaves exhibited several therapeutic potentials such as antioxidant, antimicrobial, antiviral, anthelmintic, molluscicidal, antifertility, anti-inflammatory, antidiabetic, antihyperlipidemic, anticancer, antianxiety, and mosquito repellant properties. An updated chemical study of S. sesban leaves has provided a variety of essential metabolites belonging to different chemical classes including steroids, triterpenoids, saponins, flavonoids, coumarins, lipids, and other miscellaneous compounds. The correlations between biological activities and phytoconstituents are discussed. Conclusion: This article represents an updated comprehensive evaluation of the phytochemical and biological studies of S. sesban leaves.

Spinacia oleracea L., Amaranthaceae, leaves cultivated in Egypt demonstrated a potential antileukemic activity against the chronic myeloid leukemia, K562 cell line. Thus, the aim of this study is to carry out a phytochemical investigation of S. oleracea leaves as well as the isolation of its antileukemic phytoconstituents. Phytochemical investigation of S. oleracea leaves resulted in the isolation of seventeen known compounds. The biological study revealed that compounds hexaprenol, phytol, and 18-[(1-oxohexadecyl) oxy]-9-octadecenoic acid exhibited a remarkable antiproliferative activity against K562 cells in vitro. A mechanistic in silico study showed that hexaprenol, phytol, and 18-[(1-oxohexadecyl) oxy]-9-octadecenoic acid exhibited a strong binding affinity towards topoisomerase (docking score −12.50, −9.19, and −13.29 kcal/mol, respectively), and showed as well a strong binding affinity towards Abl kinase (docking score −11.91, −9.35, and −12.59 kcal/mol, respectively). Molecular dynamics study revealed that 18-[(1-oxohexadecyl) oxy]-9-octadecenoic acid produced stable complexes with both topoisomerase and Abl kinase with RMSD values of 1.81 and 1.85 Å, respectively. As a result of our findings, we recommend more in vivo and preclinical studies to confirm the potential benefit of spinach leaves for chronic myeloid leukemia patients. Graphical Abstract