PMID- 37817655 OWN - NLM STAT- Publisher LR - 20231020 IS - 1875-6220 (Electronic) IS - 1570-1638 (Linking) DP - 2023 Oct 10 TI - Nutritional Profile, GC-MS Analysis and In-silico Anti-diabetic Phytocompounds Candidature of Jatropha gossypifolia Leaf Extracts. LID - 10.2174/0115701638267143230925172207 [doi] AB - BACKGROUND: Diabetes mellitus (DM) is a metabolic disorder known to impair many physiological functions via reactive oxygen species (ROS). Aldose reductase, sorbitol dehydrogenase, dipeptidyl peptidase IV, alpha-amylase and alpha-glucosidase are pharmacotherapeutic protein targetsin type-2 diabetes mellitus (T2DM). Inhibitors of these enzymes constitute a new class of drugs used in the management and treatment of T2DM. Some reports have claimed that medicinal plant extracts that serves as food (and as an antioxidant source) can reduce these alterations by eliminating ROS caused by DM. Ethnobotanical survey claims Jatropha gossypifolia commonly called "fig-nut" and "Lapa- lapa" in the Yoruba land of South-western Nigeria, to be used for the treatment and management of diabetes, in addition to its nutritive value. OBJECTIVE: The nutritional composition and in-silico antidiabetic potential of the bioactive constituents of J. gossypifolia leaf extracts were investigated. METHODS: Proximate, minerals and gas chromatography-mass spectroscopy (GC-MS) analysis were carried out using standard procedures. Phytocompounds present in J. gossypifolia methanol (JGM) and ethyl acetate (JGE) leaf extracts were tested as potential antagonists of selected protein targets via in-silico techniques. Drug-likeness, pharmacokinetic properties and toxicity of the promising docked ligands were also predicted. RESULTS: Proximate, minerals and gas chromatography-mass spectroscopy (GC-MS) analysis were carried out using standard procedures. Phytocompounds present in J. gossypifolia methanol (JGM) and ethyl acetate (JGE) leaf extracts were tested for their potential antagonistic effects on selected protein targets via in-silico techniques. Drug-likeness, pharmacokinetic properties and toxicity of the promising docked ligands were also predicted. Results: The proximate and mineral analysis revealed CONCLUSION: Benzene-1,2,4,5-tetramethyl from JGE extracts exhibited the most promising antidia- betic potential in-silico, suggesting its candidature as diabetes-target-protein inhibitor which may be developed for the treatment of type-2 diabetes mellitus. CI - Copyright(c) Bentham Science Publishers; For any queries, please email at epub@benthamscience.net. FAU - Awote, Olasunkanmi Kayode AU - Awote OK AUID- ORCID: 0000-0002-0727-3998 AD - 1Department of Biochemistry, Faculty of Science, Lagos State University, Ojo, Nigeria FAU - Kanmodi, Rahmon Ilesanmi AU - Kanmodi RI AUID- ORCID: 0000-0003-4906-4067 AD - 1Department of Biochemistry, Faculty of Science, Lagos State University, Ojo, Nigeria FAU - Ebube, Success Chidera AU - Ebube SC AUID- ORCID: 0009-0001-6676-1545 AD - 1Department of Biochemistry, Faculty of Science, Lagos State University, Ojo, Nigeria FAU - Abdulganniyyu, Zainab Folashade AU - Abdulganniyyu ZF AUID- ORCID: 0009-0006-2648-5028 AD - 1Department of Biochemistry, Faculty of Science, Lagos State University, Ojo, Nigeria LA - eng PT - Journal Article DEP - 20231010 PL - United Arab Emirates TA - Curr Drug Discov Technol JT - Current drug discovery technologies JID - 101157212 SB - IM OTO - NOTNLM OT - Carbohydrate metabolizing enzymes OT - Diabetes mellitus OT - Jatropha gossypifolia OT - Nutraceutical OT - Phytochemistry OT - Protein targets OT - Proximate analysis EDAT- 2023/10/11 06:45 MHDA- 2023/10/11 06:45 CRDT- 2023/10/11 03:35 PHST- 2023/06/13 00:00 [received] PHST- 2023/08/17 00:00 [revised] PHST- 2023/08/31 00:00 [accepted] PHST- 2023/10/11 06:45 [medline] PHST- 2023/10/11 06:45 [pubmed] PHST- 2023/10/11 03:35 [entrez] AID - CDDT-EPUB-135037 [pii] AID - 10.2174/0115701638267143230925172207 [doi] PST - aheadofprint SO - Curr Drug Discov Technol. 2023 Oct 10. doi: 10.2174/0115701638267143230925172207.