Article
Environmental Sciences
Aslihan Sur Arslan, Ismail Seven, Seda Iflazoglu Mutlu, Gozde Arkali, Nurgul Birben, Pinar Tatli Seven
Summary: This study evaluated the ameliorative role of quercetin in laying quails exposed to lead poisoning. The results showed that quercetin supplementation can alleviate the oxidative stress, biochemical changes, and apoptosis caused by lead exposure in quails.
ECOTOXICOLOGY AND ENVIRONMENTAL SAFETY
(2022)
Article
Biochemistry & Molecular Biology
Katerina Makarova, Ewa Olchowik-Grabarek, Krzysztof Drabikowski, Justyna Kurkowiak, Katarzyna Zawada
Summary: The aim of this study was to investigate the possible degradation path of BPA under the Fenton reaction and compare the cytotoxicity of BPA and its intermediate products. The DFT calculations revealed that the formation of hydroquinone was the most energetically favorable path in a water environment. The cytotoxicity tests showed that BPA induced the strongest hemolytic changes in erythrocytes, followed by hydroquinone, phenol and 4-isopropylphenol.
INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES
(2023)
Article
Agriculture, Dairy & Animal Science
Abdallah Tageldein Mansour, Heba H. Mahboub, Rehab M. Amen, Marwa A. El-Beltagy, Amany Ramah, Abdelfattah M. Abdelfattah, Hossam S. El-Beltagi, Tarek A. Shalaby, Hesham S. Ghazzawy, Khaled M. A. Ramadan, Adnan H. M. Alhajji, Heba S. Hamed
Summary: This study investigated the protective effect of dietary quercetin supplementation on Nile tilapia exposed to ABM. The results showed that ABM exposure caused hematological and biochemical alterations as well as hepato-renal oxidative stress, while quercetin supplementation improved these alterations and alleviated oxidative stress in a dose-dependent manner.
Article
Chemistry, Physical
Mrugesh Trivedi, Chirag N. Patel, Druma Vaidya, Nirav P. Raval, Manish Kumar
Summary: The study aimed to investigate the effects of BPA on DNA damage and cytotoxicity in HepG2 cell line at concentrations ranging from 0.02-200μg/mL, as well as the ameliorating effect of GA (10-50μg/mL). The results showed that BPA was not genotoxic and cytotoxic at low dose exposure (0.02μg/mL), but induced significant DNA damage and cytotoxicity in a dose-dependent manner at concentrations of 2-200μg/mL. However, the addition of GA (10-50μg/mL) with BPA (200μg/mL) inhibited DNA damage and cytotoxicity.
JOURNAL OF MOLECULAR STRUCTURE
(2023)
Article
Biochemistry & Molecular Biology
Rashmi S. Tupe, Nilima Bangar, Akib Nisar, Amruta Kulkarni, Neena Sankhe, Rohan Chauhan, Nidhi Mistry, Shamim Shaikh
Summary: Piperine demonstrates preventive, protective, and therapeutic effects on albumin glycation, while also safeguarding red blood cells from oxidative damage induced by glycated albumin.
JOURNAL OF FOOD BIOCHEMISTRY
(2021)
Article
Pharmacology & Pharmacy
Khaled Abo-EL-Sooud, Yasmina M. M. Abd-Elhakim, Mohamed M. M. Hashem, Abeer E. E. El-Metwally, Bayan A. A. Hassan, Hayat H. M. El-Nour
Summary: The study aimed to evaluate the potential protective role of quercetin against oxidative hepatotoxicity induced by aluminum oxide nanoparticles and lead acetate co-exposure. The results showed that quercetin significantly reduced hepatic enzymes, improved liver tissue damage, and protected the liver from the harmful effects of aluminum oxide nanoparticles and lead toxicity.
NAUNYN-SCHMIEDEBERGS ARCHIVES OF PHARMACOLOGY
(2023)
Article
Endocrinology & Metabolism
Sarmistha Saha, Brigitta Buttari, Elisabetta Profumo, Luciano Saso
Summary: This study investigated the antioxidant activity of major bioactive components of Macrotyloma uniflorum (MU) against the pro-oxidant effects triggered by sodium oxalate. They performed molecular docking, molecular dynamics simulations, and in vitro experiments to determine the antioxidant potential of MU extract and Quercetin, Kaempferol, and Sitosterol. The results showed that MU extract and the bioactive components were able to counteract sodium oxalate-induced oxidative stress, with Quercetin being the most effective compound.
JOURNAL OF BIOLOGICAL REGULATORS AND HOMEOSTATIC AGENTS
(2023)
Article
Multidisciplinary Sciences
Shaimaa M. M. Saleh, A. Bakr Mahmoud, M. Bassam Al-Salahy, Fatma Ahmed Mohamed Moustafa
Summary: This study aimed to determine the effect of gallic acid (GA) on ameliorating bisphenol A (BPA) nephrotoxicity in male rat kidneys. The results revealed morphological, immunohistochemical, and biochemical alterations in the kidney. Most of these changes showed a satisfactory improvement of kidney damage when BPA-administered rats were treated with GA at both doses.
SCIENTIFIC REPORTS
(2023)
Article
Environmental Sciences
Despoina Giamaki, Malamati Tsiotsiou, Sevnta Chousein Oglou, Maria Touraki
Summary: The bidirectional interactions between Artemia franciscana and BPA, either alone or after probiotic treatment, were assessed. BPA induced oxidative stress in Artemia, while probiotic treatment before BPA exposure increased survival and enzyme activities. BPA levels decreased over time, more significantly in the probiotic series, indicating biotransformation. Probiotics alleviate the oxidative stress response induced by BPA and enhance its biotransformation ability in Artemia.
ENVIRONMENTAL TOXICOLOGY AND PHARMACOLOGY
(2023)
Article
Toxicology
Meltem Uzunhisarcikli, Fatma Gokce Apaydin, Hatice Bas, Yusuf Kalender
Summary: This study aimed to determine the potential ameliorative effects of quercetin and/or curcumin on fipronil-induced nephrotoxicity in rats. The supplementation of quercetin and/or curcumin significantly improved fipronil-induced alterations in renal function markers, antioxidant enzyme activities, malondialdehyde levels, and histological features of renal tissue.
TOXICOLOGY RESEARCH
(2023)
Article
Chemistry, Multidisciplinary
Asiya Bashir, Muhammad Asif, Malik Saadullah, Mohammad Saleem, Syed Haroon Khalid, Liaqat Hussain, Ikram Ullah Khan, Hafiza Sidra Yaseen, Hafiz Muhammad Zubair, Muhammad Usman Shamas, Raghdaa Al Zarzour, Tahir Ali Chohan
Summary: The study found that Melilotus indicus has anti-inflammatory and anticancer properties. The ethanolic extract of Melilotus indicus showed potential in attenuating skin carcinogenesis in an animal model. Quercetin and coumarin, the primary phytochemicals in Melilotus indicus, also exhibited anticancer effects against skin cancer. Furthermore, the extract demonstrated antiangiogenic properties and decreased levels of carcinoembryonic antigen and tumor necrosis factor-alpha in the serum. Docking studies indicated the binding potential of quercetin and coumarin with certain proteins related to cancer. Further research is needed to explore the potential of Melilotus indicus and its bioactive molecules as adjuvant therapy with low dose anticancer drugs.
Article
Obstetrics & Gynecology
Navid Jamali, Fatemeh Zal, Zohreh Mostafavi-Pour, Mohammad Samare-Najaf, Tahereh Poordast, Amirreza Dehghanian
Summary: The combination of quercetin and metformin showed potential therapeutic effects on a rat model of endometriosis, significantly reversing the increased levels of serum TNF-α and 17β-estradiol, and significantly affecting the size of endometrial implants and gene expression levels of mTOR and autophagy markers in ectopic endometrium.
REPRODUCTIVE SCIENCES
(2021)
Article
Chemistry, Medicinal
Md. Niyaz Alam, Lubhan Singh, Najam Ali Khan, Yahya I. Asiri, Mohd. Zaheen Hassan, Obaid Afzal, Abdulmalik Saleh Alfawaz Altamimi, Md. Sarfaraj Hussain
Summary: This study investigated the pharmacological effects of ethanolic extract of M. oleifera leaves and curcumin against epilepsy. The results showed that they had certain effects in alleviating seizures, improving cognitive impairment, and reducing oxidative stress. The combination of M. oleifera and curcumin had better anti-epileptic effects compared to other combinations.
Article
Biochemistry & Molecular Biology
May M. Alsaud, Ahmad H. Alhowail, Maha A. Aldubayan, Ibtesam S. Almami
Summary: This study aimed to determine the protective effect of pioglitazone against doxorubicin-induced cognitive impairment. The results showed that pioglitazone treatment alleviates doxorubicin-induced cognitive impairment by modulating the expression of inflammatory cytokines and reducing neuronal inflammation.
Article
Biochemistry & Molecular Biology
Natalia Pereira da Silva Araujo, Natalia Alves de Matos, Michel Oliveira, Ana Beatriz Farias de Souza, Thalles de Freitas Castro, Pedro Alves Machado-Junior, Debora Maria Soares de Souza, Andre Talvani, Silvia Dantas Cangussu, Rodrigo Cunha Alvim de Menezes, Frank Silva Bezerra
Summary: Chronic obstructive pulmonary disease (COPD) is a leading cause of disability and mortality worldwide, with cigarette smoke playing a key role in its development. Quercetin may have potential as a preventive agent for smoke-induced pulmonary emphysema.
Article
Biochemistry & Molecular Biology
Rajan Rolta, Deeksha Salaria, Vikas Kumar, Chirag N. Patel, Anuradha Sourirajan, David J. Baumler, Kamal Dev
Summary: Rheum emodi Wall. has pharmacological activities such as antioxidant, antimicrobial, antiviral, anticancer and wound healing. This study aimed to investigate the binding abilities of major phytocompounds of R. emodi to proteins responsible for antibiotic resistance in bacterial and fungal pathogens, and their potential to enhance the potency of antibiotics. The docking study showed that emodin and rhein-13C6 exhibited the best binding affinity against bacterial and fungal targets, respectively. These phytocompounds also fulfilled Lipinski rule and showed non-toxicity.
JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS
(2022)
Article
Biochemistry & Molecular Biology
Chirag N. Patel, Dweipayan Goswami, Prasanth Kumar Sivakumar, Himanshu A. Pandya
Summary: In order to combat COVID-19 caused by SARS-CoV-2, potential fusion inhibitors from anticancer phytochemicals are being identified through molecular docking and molecular dynamics simulations, with Theaflavin, Ginkgetin, Ursolic acid, Silymarin and Spirosolane showing promise as candidates to prevent viral entry into human cells.
JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS
(2022)
Article
Biochemistry & Molecular Biology
Deeksha Salaria, Rajan Rolta, Chirag N. Patel, Kamal Dev, Anuradha Sourirajan, Vikas Kumar
Summary: Wild thyme has been found to have good antimicrobial and synergistic potential, with its major phytocompound thymol enhancing the efficacy of antibiotics against bacterial and fungal pathogens. This could be a significant finding in the fight against antimicrobial drug resistance.
JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS
(2022)
Article
Chemistry, Physical
Ajay L. Desai, Keyur Bhatt, Krunal M. Modi, Nihal P. Patel, Manthan Panchal, Anita Kongor, Chirag N. Patel, Alan Liska
Summary: The interaction between a novel calix[4]pyrrole bearing carboxylic acid functionality (ABCP) and amino acids in methanol was investigated. The ABCP-Tryptophan complex showed a blue shift in absorption spectra, indicating charge transfer mediated recognition. Furthermore, density functional theory calculations supported a possible 1:1 binding mechanism between Tryptophan and ABCP. Other parameters such as stability, softness, hardness, and chemical potential were also calculated to understand the binding behavior of ABCP as the host and Tryptophan as the guest. The Natural Bond Orbital and TDDFT calculation facilitated a better understanding of the binding mechanism based on experimental results.
Article
Biochemistry & Molecular Biology
Kinjal Bhadresha, Sivakumar Prasanth Kumar, Jpan Brahmbhatt, Chirag Patel, Pujan Pandya, Nayan Jain, Rakesh Rawal
Summary: This study identified theaflavin-3-gallate as a promising natural inhibitor of Hsp90, which can significantly inhibit cell proliferation, induce cell death, reduce cell migration and colony formation in breast cancer cells, and downregulate the expression of several related genes. This compound has the potential to improve the efficacy of existing breast cancer therapies and overall survival of patients.
CHEMICO-BIOLOGICAL INTERACTIONS
(2022)
Article
Biochemistry & Molecular Biology
Chirag N. Patel, Dweipayan Goswami, Dharmesh G. Jaiswal, Siddhi P. Jani, Robin M. Parmar, Rakesh M. Rawal, Himanshu A. Pandya
Summary: The study suggests that phytochemicals from certain medicinal plants possess antiviral potentials against COVID-19 and other related viruses. Further research on these plant-derived compounds could lead to the development of new therapeutic strategies.
JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS
(2023)
Article
Biochemistry & Molecular Biology
Deeksha Salaria, Rajan Rolta, Nitin Sharma, Chirag N. Patel, Arabinda Ghosh, Kamal Dev, Anuradha Sourirajan, Vikas Kumar
Summary: The study evaluated the anti-inflammatory and antioxidant potential of Cymbopogon citratus essential oil, showing significant in vitro antioxidant and anti-inflammatory activities. Molecular docking analysis revealed promising binding potential of the major phytocompounds with human peroxiredoxin 5 and human cyclooxygenase 2, which was further supported by molecular dynamics simulations.
JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS
(2022)
Article
Chemistry, Applied
Smita Mall, Reetika Srivastava, Nitin Sharma, Chirag N. Patel, Rajan Rolta, Anuradha Sourirajan, Kamal Dev, Arabinda Ghosh, Vikas Kumar
Summary: The study showed that chasmanthin and palmarin have strong binding and inhibitory effects on ACE protein, making them suitable as novel target inhibitors for combating hypertension. They also exhibit favorable drug likeness and pharmacokinetics properties, suggesting their potential use in hypertension treatment.
NATURAL PRODUCT RESEARCH
(2022)
Article
Chemistry, Multidisciplinary
Sivakumar Prasanth Kumar, Nandan Y. Dixit, Chirag N. Patel, Rakesh M. Rawal, Himanshu A. Pandya
Summary: PharmRF is a structure-based pharmacophore scoring function that selects crystal structures with high enrichment rates and provides a better basis for pharmacophore enumeration. Evaluation on multiple datasets shows that PharmRF has high success rates and correlation.
JOURNAL OF COMPUTATIONAL CHEMISTRY
(2022)
Article
Biology
Naman Mangukia, Priyashi Rao, Kamlesh Patel, Himanshu Pandya, Rakesh M. Rawal
Summary: This article discusses the interaction of plant-derived miRNAs from fresh fruits with SARS-CoV-2 and the Omicron variant, highlighting their potential therapeutic effects and revealing how fruits help maintain the immune system.
COMPUTERS IN BIOLOGY AND MEDICINE
(2022)
Article
Biochemistry & Molecular Biology
Siddhi P. Jani, Sivakumar Prasanth Kumar, Naman Mangukia, Saumya K. Patel, Himanshu A. Pandya, Rakesh M. Rawal
Summary: This study presents a machine-learning approach to predict the binding affinity of peptides of different lengths within the MHC-II pocket. Compared to conventional methods, this approach uses crystal structures as templates and performs docking to generate conformations. The findings show that this method outperforms other methods in certain MHC-II types.
PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS
(2023)
Article
Biochemistry & Molecular Biology
Vikas Kumar, Nitin Sharma, Raha Orfali, Chirag N. Patel, Radwan Alnajjar, Rakshandha Saini, Anuradha Sourirajan, Prem Kumar Khosla, Kamal Dev, Shagufta Perveen
Summary: This study aims to identify phytochemicals from the Terminalia arjuna tree that have significant cardioprotective activity. The compound casuarinin was identified as a potential inhibitor of various cardiovascular proteins, and further simulations confirmed its strong inhibitory effect. These findings lay the groundwork for the development of broad-spectrum drugs against cardiovascular diseases.
Article
Biochemistry & Molecular Biology
Nitin Sharma, Nidhi Gupta, Raha Orfali, Vikas Kumar, Chirag N. Patel, Jiangnan Peng, Shagufta Perveen
Summary: Curcuma longa leaf essential oil exhibits strong antifungal, antioxidant, and anti-diabetic activities. The major phytocompounds in the oil show strong interactions with relevant proteins. These findings provide a theoretical basis for the development and application of Curcuma longa leaf essential oil.
Article
Biochemistry & Molecular Biology
Subhash Sharma, Vikas Kumar, Muhammad Yaseen, Amr S. Abouzied, Abgeena Arshad, Mashooq Ahmad Bhat, Ahmed M. M. Naglah, Chirag N. N. Patel, Prasanth Kumar Sivakumar, Anuradha Sourirajan, Adnan Shahzad, Kamal Dev
Summary: The present study evaluated the biological activities of roots and shoots of Potentilla nepalensis, including antioxidant, antibacterial, and anticancer activities, as well as the synergistic antibacterial activity with antibacterial drugs. The methanolic root extract showed higher total phenolic and flavonoid content, while the methanolic shoot extract showed good antioxidant activity. The hexane root extract exhibited strong cytotoxic activity against SK-MEL-28 cells. Docking studies predicted potential anticancer properties of the identified bioactive compounds. This study can contribute to the development of new herbal medicines and the creation of new medications.
Review
Toxicology
Shahid Yousuf Ganie, Darakhshan Javaid, Younis Ahmad Hajam, Mohd Salim Reshi
Summary: Arsenic toxicity is a complex and pervasive public health problem that affects millions of people worldwide. This review aims to consolidate current knowledge on arsenic toxicity, including its sources, chemical forms, and the pathways through which it affects human health. The study found that arsenic is associated with chronic diseases such as cancer, cardiovascular disorders, and neurotoxicity, and oxidative stress, genotoxicity, and epigenetic modifications play important roles in arsenic-induced cellular damage. Further research is needed to fill gaps in our understanding of arsenic toxicity and inform public health policies aimed at minimizing exposure.
TOXICOLOGY RESEARCH
(2024)
Article
Toxicology
Lu Zhang, Min Li, Dalong Zhang, Shujing Zhang, Li Zhang, Xiaojun Wang, Zhiyong Qian
Summary: With the increasing incidence of neurodevelopmental disorders, it is important to screen and evaluate developmental neurotoxicity (DNT) compounds from a large number of environmental chemicals and understand their mechanisms. This study conducted a DNT qualitative structure-activity relationship (QSAR) study for the first time, and preliminarily illustrated the structural characterization of DNT compounds. Multiple models and methods were used to construct prediction models, resulting in the best model with good predictive ability. By combining different models, both MCC values and application domain values were improved. Additionally, through modeling descriptors analysis and structure alerts (SAs) identification, electronical properties, van der Waals volume-related properties, and S, Cl or P containing substructure were found to be associated with DNT. This study lays a foundation for further DNT prediction of environmental exposures in human and contributes to the understanding of DNT mechanism.
TOXICOLOGY RESEARCH
(2024)
Article
Toxicology
Khushboo Sharma, Satish Koundal, Mandeep Singh, Pooja Chadha, Harvinder Singh Saini
Summary: The unregulated discharge of untreated or partially treated industrial wastewater poses a serious threat to aquatic ecosystems. This study exposed Channa punctata fish to untreated and microbially treated textile industry effluent to analyze their toxicity effects. The results showed that the untreated effluent group had more severe hematological, biochemical, histopathological, and ultrastructural alterations compared to the microbially treated group. This highlights the importance of finding more effective microbial treatments to protect aquatic life and human health.
TOXICOLOGY RESEARCH
(2024)
Article
Toxicology
Chen Gu, Yan Sun, Meiqi Mao, Jinguo Liu, Xiongyao Li, Xiaoping Zhang
Summary: This study investigated the mechanism of lunar dust simulant (CLDS-i) in inducing inflammatory lung injury. The results showed that CLDS-i regulated immune inflammatory cells and activated signaling pathways related to inflammatory diseases, promoting the occurrence and development of inflammatory injury. The study also found that amino acid metabolism imbalance might be related to the activation of the NF-kappa B signaling pathway.
TOXICOLOGY RESEARCH
(2024)