scholarly journals Therapeutic Potential of Tuna Backbone Peptide and Its Analogs: An In Vitro and In Silico Study

Molecules ◽  
2021 ◽  
Vol 26 (7) ◽  
pp. 2064
Author(s):  
Varun Gopinatth ◽  
Rufa L. Mendez ◽  
Elaine Ballinger ◽  
Jung Yeon Kwon
Keyword(s):  
In Silico ◽  
Bioactive Peptides ◽  
Therapeutic Potential ◽  
Antioxidant Activities ◽  
Radical Scavenging ◽  
Activity Assay ◽  
In Silico Study ◽  
The Impact ◽  
Potent Inhibitory Activity

Tuna backbone peptide (TBP) has been reported to exert potent inhibitory activity against lipid peroxidation in vitro. Since this bears relevant physiological implications, this study was undertaken to assess the impact of peptide modifications on its bioactivity and other therapeutic potential using in vitro and in silico approach. Some TBP analogs, despite lower purity than the parent peptide, exerted promising antioxidant activities in vitro demonstrated by ABTS radical scavenging assay and cellular antioxidant activity assay. In silico digestion of the peptides resulted in the generation of antioxidant, angiotensin-converting enzyme (ACE), and dipeptidyl peptidase-IV (DPPIV) inhibitory dipeptides. Using bioinformatics platforms, we found five stable TBP analogs that hold therapeutic potential with their predicted multifunctionality, stability, non-toxicity, and low bitterness intensity. This work shows how screening and prospecting for bioactive peptides can be improved with the use of in vitro and in silico approaches.

scholarly journals A Review of Recent Studies on the Antioxidant Activities of a Third-Millennium Food: Amaranthus spp.

Antioxidants ◽  
2020 ◽  
Vol 9 (12) ◽  
pp. 1236
Author(s):  
Seon-Joo Park ◽  
Anshul Sharma ◽  
Hae-Jeung Lee
Keyword(s):  
Antioxidant Activity ◽  
Bioactive Peptides ◽  
Antioxidant Activities ◽  
Radical Scavenging Activity ◽  
Radical Scavenging ◽  
Sustainable Food ◽  
Amaranth Species ◽  
Amaranthus Spp

Amaranth (Amaranthus spp.) plant commonly refers to the sustainable food crop for the 21st century. The crop has witnessed significant attention in recent years due to its high nutritional value and agronomic advantages. It is a relatively well-balanced cosmopolitan food that is a protector against chronic diseases. Usually, the antioxidant activities of amaranth are held responsible for its defensive behavior. Antioxidant activity of plants, generally, is attributed to their phytochemical compounds. The current interest, however, lies in hydrolysates and bioactive peptides because of their numerous biological functions, including antioxidant effect. While the importance of bioactive peptides has been progressively recognized, an integrated review of recent studies on the antioxidant ability of amaranth species, especially their hydrolysates and peptides has not been generated. Hence, in this review, we summarize studies focused on the antioxidant capacity of amaranth renewal over the period 2015–2020. It starts with a background and overall image of the amaranth-related published reviews. The current research focusing on in vitro, in vivo, and chemical assays-based antioxidant activity of different amaranth species are addressed. Finally, the last segment includes the latest studies concerning free radical scavenging activity and metal chelation capacity of amaranth protein hydrolysates and bioactive peptides.

scholarly journals In Vitro Antioxidant Activities of Methanolic Extracts of Caesalpinia volkensii Harms., Vernonia lasiopus O. Hoffm., and Acacia hockii De Wild

2020 ◽  
Vol 2020 ◽  
pp. 1-10
Author(s):  
Beatrice Muthoni Guchu ◽  
Alex King’ori Machocho ◽  
Stephen Kiruthi Mwihia ◽  
Mathew Piero Ngugi
Keyword(s):  
Oxidative Stress ◽  
Therapeutic Potential ◽  
Antioxidant Activities ◽  
Antioxidant Properties ◽  
Radical Scavenging ◽  
Antioxidant Power ◽  
Chain Reactions ◽  
Methanolic Extracts ◽  
Ferric Reducing Antioxidant Power

Oxidative stress is the result of the disparity between pro-oxidants and antioxidants in an organism, and it is important in the pathogenesis of several degenerative disorders, such as arthritis, Alzheimer’s, cancer, and cardiovascular diseases. Free radicals can damage biomolecules, such as nucleic acids, lipids, proteins, polyunsaturated fatty acids, and carbohydrates, and the DNA leading to mutations. The use of antioxidants is effective in delaying the oxidation of biomolecules. Antioxidants are complexes found in the food that can retard or deter oxidation by preventing the initiation and propagation of oxidizing chain reactions. Medicinal plants have been used for centuries by man to manage diseases and have a host of antioxidant complexes. Traditionally, Caesalpinia volkensii, Vernonia lasiopus, and Acacia hockii have folkloric remedies against associated oxidative stress-mediated complications. However, the upsurge in its use has not been accompanied by scientific validations to support these claims. In this study, in vitro antioxidant activity of Caesalpinia volkensii, Vernonia lasiopus, and Acacia hockii collected from Embu County (Kenya) were determined by radical scavenging activities of 1,1-diphenyl-2-picrylhydrazyl (DPPH) and hydroxyl radical in addition to ferric reducing antioxidant power analyzed against that of L-ascorbic acid as the standard. The obtained results revealed remarkable antioxidant activities of the studied plant extracts as evidenced by the low IC50 and EC50 values. These antioxidant activities could be due to the presence of antioxidants phytochemicals such as flavonoids, phenols, terpenoids, and saponins among others. Therefore, the therapeutic potential of this plant could be due to their antioxidant properties. This study recommends bioassay of the extracts against oxidative stress-related disorders for development of phytomedicine with antioxidant properties.

Therapeutic potential of Taraxacum officinale against HCV NS5B polymerase: In-vitro and In silico study

2016 ◽  
Vol 83 ◽  
pp. 881-891 ◽  
Author(s):  
Sidra Rehman ◽  
Bushra Ijaz ◽  
Nighat Fatima ◽  
Syed Aun Muhammad ◽  
Sheikh Riazuddin
Keyword(s):  
In Silico ◽  
Therapeutic Potential ◽  
Taraxacum Officinale ◽  
In Silico Study ◽  
Hcv Ns5b ◽  
Ns5b Polymerase

scholarly journals Antioxidant Activities of Alkyl Substituted Pyrazine Derivatives of Chalcones—In Vitro and In Silico Study

Antioxidants ◽  
2019 ◽  
Vol 8 (4) ◽  
pp. 90 ◽  
Author(s):  
Višnja Stepanić ◽  
Mario Matijašić ◽  
Tea Horvat ◽  
Donatella Verbanac ◽  
Marta Kučerová-Chlupáčová ◽  
...  
Keyword(s):  
In Silico ◽  
Density Functional ◽  
Antioxidant Activities ◽  
Radical Scavenging Activity ◽  
Radical Scavenging ◽  
Redox Status ◽  
Trypan Blue Exclusion ◽  
Cellular Effects ◽  
Dft Modeling

Chalcones are polyphenolic secondary metabolites of plants, many of which have antioxidant activity. Herein, a set of 26 synthetic chalcone derivatives with alkyl substituted pyrazine heterocycle A and four types of the monophenolic ring B, were evaluated for the potential radical scavenging and antioxidant cellular capacity influencing the growth of cells exposed to H2O2. Before that, compounds were screened for cytotoxicity on THP-1 and HepG2 cell lines. Most of them were not cytotoxic in an overnight MTS assay. However, three of them, 4a, 4c and 4e showed 1,1-diphenyl-2-picrylhydrazyl (DPPH●) radical scavenging activity, through single electron transfer followed by a proton transfer (SET-PT) mechanism as revealed by density functional theory (DFT) modeling. DFT modeling of radical scavenging mechanisms was done at the SMD//(U)M052X/6-311++G** level. The in vitro effects of 4a, 4c and 4e on the growth of THP-1 cells during four days pre- or post-treatment with H2O2 were examined daily with the trypan blue exclusion assay. Their various cellular effects reflect differences in their radical scavenging capacity and molecular lipophilicity (clogP) and depend upon the cellular redox status. The applied simple in vitro-in silico screening cascade enables fast identification and initial characterization of potent radical scavengers.

scholarly journals Phytochemical screening, mineral composition and in vitro antioxidant activities of Pterocarpus mildbraedii leaves

2016 ◽  
Vol 4 (1) ◽  
pp. 23 ◽  
Author(s):  
Usunomena Usunobun ◽  
Igwe V. Chinwe
Keyword(s):  
Therapeutic Potential ◽  
Antioxidant Activities ◽  
Radical Scavenging Activity ◽  
Radical Scavenging ◽  
Reducing Power ◽  
Antioxidant Property ◽  
Phytochemical Screening ◽  
Mineral Analysis ◽  
Biochemical Basis

Background: Pterocarpus mildbraedii is used in some Nigerian tribes in the treatment of headaches, pains, fever, convulsions, and respiratory disorders. This study was carried out to ascertain the phytochemicals, minerals and in vitro antioxidant activities of Pterocarpus mildbraedii leaves.Methods: Qualitative phytochemical screening was carried out using standard procedures while Mineral analysis was carried out using Atomic Absorption Spectrophotometer (AAS). Also, antioxidant activities of Pterocarpus mildbraedii leaves were evaluated using reducing power ability and 2,2-Diphenyl-1-picrylhydrazyl (DPPH) radical scavenging assays.Results: Result on phytochemicals reveals the presence of flavonoids, saponins, alkaloids, tannins. Mineral analysis showed calcium (1283mg/kg) to be higher in concentration and manganese (4mg/kg) least in concentration (4mg/kg). Other analysed minerals include sodium (603mg/kg), potassium (1048mg/kg), magnesium (778mg/kg), zinc (25mg/kg), iron (146mg/kg), phosphates (1002mg/kg), etc. In vitro antioxidant activity results show that Pterocarpus mildbraedii possess potent but dose-dependent reducing power ability and free radical scavenging activity against 2,2-diphenyl-1-picrylhydrazyl (DPPH) radicals.Conclusion: The presence of phytochemicals such as flavonoids, saponins, alkaloids and tannins in Pterocarpus mildbraedii provides some biochemical basis for the ethno pharmacological uses of the plant. Also the information provided in this research study may help to spread the ethno botanical uses of Pterocarpus mildbraedii leaves to other parts of the World. The findings clearly demonstrate that Pterocarpus mildbraedii leaves have promising antioxidant property and needs further evaluation to exploit its therapeutic potential.

An in vitro and in silico study of the impact of engineered surface modifications on drug detachment from model carriers

2016 ◽  
Vol 513 (1-2) ◽  
pp. 109-117 ◽  
Author(s):  
Shengqian Wu ◽  
Sarah Zellnitz ◽  
Annalisa Mercuri ◽  
Sharareh Salar-Behzadi ◽  
Massimo Bresciani ◽  
...  
Keyword(s):  
In Silico ◽  
Surface Modifications ◽  
In Silico Study ◽  
The Impact

scholarly journals Bioactive peptides from beef products fermented by acid whey – in vitro and in silico study

2019 ◽  
Vol 76 (4) ◽  
pp. 311-320 ◽  
Author(s):  
Paulina Kęska ◽  
Karolina Maria Wójciak ◽  
Joanna Stadnik
Keyword(s):  
In Silico ◽  
Bioactive Peptides ◽  
In Silico Study ◽  
Beef Products ◽  
Acid Whey

scholarly journals Phytochemical analysis, mineral composition and in vitro antioxidant activities of Celosia argentea leaves

2016 ◽  
Vol 4 (1) ◽  
pp. 19
Author(s):  
Usunomena Usunobun ◽  
Ekpemupolo I. Samuel
Keyword(s):  
Mineral Composition ◽  
Therapeutic Potential ◽  
Antioxidant Activities ◽  
Radical Scavenging ◽  
Reducing Power ◽  
Phytochemical Analysis ◽  
Scavenging Activity ◽  
Mineral Analysis ◽  
Celosia Argentea

Background: Celosia argentea, a traditional vegetable in West and Central Africa is widely grown for ornamental purpose in the tropics and subtropics such as in Malaysia. The aim of this study is to determine phytochemicals, mineral composition and in vitro antioxidant activities of Celosia argentea leaves.Methods: Qualitative phytochemical screening was carried out using standard procedures, Mineral analysis was carried out using Atomic Absorption Spectrophotometer (AAS) while antioxidant potential, free radical scavenging and reducing power scavenging activity were also carried out.Results: The phytochemical composition revealed the presence of active ingredients such as glycosides, steroids, Saponins, Phenols, Flavonoids, and alkaloids while mineral analysis showed higher concentration in calcium (295mg/100g) and least concentration in chromium (0.85mg/100g). Other minerals and their concentrations includes magnesium (122.53mg/100g), potassium (128.33mg/100g), sodium (71.32mg/100g), iron (35.16mg/100g), zinc (5.42mg/100g), copper (2.18mg/100g), manganese (1.86mg/100g). Moreover, DPPH (2, 2-diphenyl-1-picrylhydrazyl) scavenging activity and reducing power activity of Celosia argentea increased as the concentration increases.Conclusion: The present study reveals therapeutic potential of Celosia argentea leaves due to its bioactive compounds and minerals. Also, Celosia argentea possess powerful antioxidant activity and can therefore offer good protection against oxidative damage.

Acetylcholinesterase Inhibitory Potential and Antioxidant Activities of Five Cultivars of Rosa Damascena Mill. From Isparta, Turkey

2020 ◽  
Vol 18 (4) ◽  
pp. 354-359
Author(s):  
Shirin Tarbiat ◽  
Azize Simay Türütoğlu ◽  
Merve Ekingen
Keyword(s):  
Alzheimer’S Disease ◽  
Alzheimer's Disease ◽  
Free Radical ◽  
Neurodegenerative Disorder ◽  
Antioxidant Activities ◽  
Radical Scavenging ◽  
Acetylcholinesterase Activity ◽  
Rosa Damascena ◽  
Free Radical Damage

Alzheimer's disease is a neurodegenerative disorder characterized by memory loss and impairment of language. Alzheimer's disease is strongly associated with oxidative stress and impairment in the cholinergic pathway, which results in decreased levels of acetylcholine in certain areas of the brain. Hence, inhibition of acetylcholinesterase activity has been recognized as an acceptable treatment against Alzheimer's disease. Nature provides an array of bioactive compounds, which may protect against free radical damage and inhibit acetylcholinesterase activity. This study compares the in vitro antioxidant and anticholinesterase activities of hydroalcoholic extracts of five cultivars of Rosa Damascena Mill. petals (R. damascena 'Bulgarica', R. damascena 'Faik', R. damascena 'Iranica', R. damascena 'Complex-635' and R. damascena 'Complex-637') from Isparta, Turkey. The antioxidant activities of the hydroalcoholic extracts were tested for ferric ion reduction and DPPH radical scavenging activities. The anti-acetylcholinesterase activity was also evaluated. All rose cultivars showed a high potency for scavenging free radical and inhibiting acetylcholinesterase activity. There was a significant correlation between antioxidant and acetylcholinesterase inhibitory activity. Among cultivars, Complex-635 showed the highest inhibitory effect with an IC50 value of 3.92 µg/mL. Our results suggest that all these extracts may have the potential to treat Alzheimer's disease with Complex-635 showing more promise.

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