Computational and Pharmacological Studies on the Antioxidant, Thrombolytic, Anti-Inflammatory, and Analgesic Activity of Molineria capitulata
| Autor: | Talha Bin Emran, Jannatul Mouah, Md. Helal Uddin Chowdhury, Md. Masudur Rahman, Duygu Ağagündüz, Fayza Islam, Arkajyoti Paul, Jesus Simal-Gandara, Raffaele Capasso, Marzia Rahman Tona, Mohammad Ashiqur Rahman Bhuiyan Shovo, Tuhin Das |
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| Přispěvatelé: | Shovo, M. A. R. B., Tona, M. R., Mouah, J., Islam, F., Chowdhury, M. H. U., Das, T., Paul, A., Agagunduz, D., Rahman, M. M., Emran, T. B., Capasso, R., Simal-Gandara, J. |
| Jazyk: | turečtina |
| Rok vydání: | 2021 |
| Předmět: |
0301 basic medicine
Antioxidant antioxidant 3209.04 Medicamentos Naturales medicine.medical_treatment Flavonoid Pharmacology thrombolytic chemistry.chemical_compound Mice 0302 clinical medicine Bioactive molecule Biology (General) ADME chemistry.chemical_classification Fibrinolytic Agent biology Medicinal plant Biological activity General Medicine Molecular Docking Simulation Anti-Inflammatory Agent Phytochemical 030220 oncology & carcinogenesis Molineria capitulata Computational study Microbiology (medical) 3309.03 Antioxidantes en Los Alimentos medicine.drug_class QH301-705.5 biological activity Molecular Dynamics Simulation Microbiology Anti-inflammatory Plant Extract 03 medical and health sciences Structure-Activity Relationship Glucoside bioactive molecules medicine Molecular Biology 2302.21 Biología Molecular Dose-Response Relationship Drug Animal biology.organism_classification 030104 developmental biology chemistry Analgesic Hypoxidaceae medicinal plants |
| Zdroj: | Current Issues in Molecular Biology, Vol 43, Iss 35, Pp 434-456 (2021) Investigo. Repositorio Institucional de la Universidade de Vigo Universidade de Vigo (UVigo) Current Issues in Molecular Biology Volume 43 Issue 2 Pages 35-456 |
| Popis: | Molineria capitulata is an ornamental plant that has traditionally been used to treat several chronic diseases. The present study was designed to examine the antioxidant, cytotoxic, thrombolytic, anti-inflammatory, and analgesic activities of a methanolic extract of M. capitulata leaves (MEMC) using both experimental and computational models. Previously established protocols were used to perform qualitative and quantitative phytochemical screening in MEMC. A computational study, including molecular docking and ADME/T analyses, was performed. The quantitative phytochemical analysis revealed the total phenolic and flavonoid contents as 148.67 and 24 mg/g, respectively. Antioxidant activity was assessed by examining the reducing power of MEMC, resulting in absorbance of 1.87 at 400 µg/mL, demonstrating a strong reduction capacity. The extract exhibited significant protection against blood clotting and showed the highest protein denaturation inhibition at 500 µg/mL. In both the acetic acid-induced writhing and formalin-induced paw-licking models, MEMC resulted in significant potential pain inhibition in mice. In the computational analysis, 4-hydroxybenzaldehyde, orcinol glucoside, curcapital, crassifogenin C, and 2,6-dimethoxy-benzoic acid displayed a strong predictive binding affinity against the respective receptors. These findings indicated that M. capitulata possesses significant pharmacological activities to an extent supported by computational studies. |
| Databáze: | OpenAIRE |
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