Jania rubens red seaweed has various bioactive compounds that can be used for several medicinal and pharmaceutical applications. In this study, we investigate the antidiabetic, anti-inflammatory, and antioxidant competency of Jania rubens polyphenolic extract (JRPE) by assessing their interactions with α-amylase, lipase, and trypsin enzymes. HPLC analysis revealed the dominance of twelve polyphenolic compounds. We performed computational analysis using α-amylase, lipase, and trypsin as target proteins for the polyphenols to explore their activities based on their predicted modes of binding sites following molecular modeling analysis. The molecular docking analysis demonstrated a good affinity score with a noticeable affinity to polyphenolic compositions of Jania rubens. The compounds with the highest affinity score for α-amylase (PDB: 4W93) were kaempferol, quercetin, and chlorogenic acid, with −8.4, −8.8 and −8 kcal/mol, respectively. Similarly, lipase (PDB: 1LPB) demonstrated high docking scores of −7.1, −7.4, and −7.2 kcal/mol for kaempferol, quercetin, and chlorogenic acid, respectively. Furthermore, for trypsin (PDB: 4DOQ) results, kaempferol, quercetin, and chlorogenic acid docking scores were −7.2, −7.2, and −7.1 kcal/mol, respectively. The docking findings were verified using in vitro evaluations, manifesting comparable results. Overall, these findings enlighten that the JRPE has antidiabetic, anti-inflammatory, and antioxidant properties using different diabetics’ enzymes that could be further studied using in vivo investigations for diabetes treatment.

This paper aimed to study the anomalous fluctuation of halogens with respect to the pollution status in surface water (w), pore water (p), and sediments (s) of Lake Mariout. It provided a framework for understanding the distribution of dissolved and precipitated halogen salts related to the pollution status of the lake. The study cleared out that bromide was only the most abundant halogen in the three studied partitions. On contrast, sediments partition contained the lowest chloride content. Fluoride minerals, especially, fluorapatites and carbonate-fluorapatite (FAP and CFAP), had high Saturation Index (SI) values in surface water (42.7751.95 and 16.0460.89, respectively) and in pore water (51.2654.60 and 17.5278.33, respectively). Bromide and chloride were mainly found in the soluble forms in the surface water and pore waters. Iodide salts, (Ca(IO₃)₂ and Ca(IO₃)₂.6H₂O), were moderately precipitated in surface and pore waters. Thus, SI content reflected that halogens, especially fluoride and iodide, played a vital role in reducing lake pollution. Fluorite (CaF₂) and sellaïte (MgF₂) could only be formed in pore water, while calcite and aragonite could be deposited from surface water. In addition, Cl was mainly found in the forms of NaCl, CaCl₂, MgCl₂, and KCl in surface and pore waters. The multivariate analysis revealed that fluoride precipitate may serve in decreasing the dissolved salt pollution. Multivariate analysis showed that in the long run, the fluoride precipitation in FAP and CFAP can significantly adsorb and absorb various pollutants and can protect the lake from pollution. The ecological risk assessment conducted by calculating the enrichment factor (EF) showed that the lake was still unpolluted. Regarding human health risks, at appropriate levels of human health and safety, the hazard quotient (HQ) and hazard index (HI) of halogens found to be lower than these reported levels. Hence, ingestion and dermal absorption routes of halogens by surface water and sediments did not pose any adverse effects to population reflecting uncontaminated status of Lake Mariout.

The present study investigated the neuroprotective and nephroprotective effects of the sponge Ircinia sp. ethyl acetate extract (ISPE) against persistent aromatic pollutants in vitro and in vivo. Different exponential experimental assays were applied to this study. An in vitro study to investigate the potential therapeutic effect of ISPE using antioxidants (for example, ABTS and DPPH) and anti-Alzheimer assays (inhibition of acetylcholinesterase); the in-vivo study was designed to evaluate the protective effect of ISPE as neuroprotective and nephroprotective against the destructive effect of PAH. Several assays included oxidative assays (LPO), antioxidant biomarkers (GSH, GST), and inflammatory and neurodegenerative biomarkers (PTK,SAA). Additionally, the results were confirmed using histopathological examination. The in silico screening study improved the in vitro and in vivo findings through interaction between the aryl hydrocarbon receptor (AHR) and the polyphenolic content of ISPE extract, which was determined using LCMSM. The results and discussion showed that ISPE exhibited a promising antioxidant and anti-acetylcholinesterase activity as evidenced by IC₅₀ values of 49.74, 28.25, and 0.18 µg/mL in DPPH, ABTS, and acetylcholinesterase inhibition assays, respectively. In vivo, the study showed that animals receiving ISPE before poly aromatic hydrocarbons administration PAHs (Prot, ISPE) showed significant amelioration in kidney functions manifested by the reduction of serum urea, uric acid, and creatinine by 40.6%, 66.4%, and 134.8%, respectively, concerning PAH-injected mice (HAA). Prot, ISPE revealed a decline in malondialdehyde (MDA) and total proteins (TP) in kidney and brain tissues by 73.63% and 50.21%, respectively, for MDA and 59.82% and 80.41%, respectively, for TP with respect to HAA. Prot, ISPE showed significant elevation in reduced glutathione (GSH) and glutathione transferase (GST) in kidney and brain tissues and reduction in the inflammatory and pre-cancerous biomarkers, namely, serum protein tyrosine kinases (PTKs) and serum amyloid A (SAA). These findings were further supported by histopathological examination of kidney and brain tissues, which revealed normal structure approaching normal control. Metabolic profiling of ISPE using LC–MS-MS showed the presence of fourteen polyphenolic compounds belonging mainly to phenolic acids and flavonoids. In silico study revealed that all the tested compounds exerted certain binding with the aryl hydrocarbon receptor, where rutin showed the best fitting (ΔG = − 7.6 kcal/mol⁻¹) with considerable pharmacokinetic and pharmacodynamic properties revealed from in silico ADME (Absorption, Distribution, Metabolism, and Excretion) study. Hence, it can be concluded that the Ircinia sponge showed a promising protective effect versus kidney and brain toxicity triggered by PAHs. Graphical Abstract