Search Results - "de Castro, Alexandre A"
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Recent Developments in Metal-Based Drugs and Chelating Agents for Neurodegenerative Diseases Treatments
Published in International journal of molecular sciences (12-04-2019)“…The brain has a unique biological complexity and is responsible for important functions in the human body, such as the command of cognitive and motor…”
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Computational evidence for nitro derivatives of quinoline and quinoline N-oxide as low-cost alternative for the treatment of SARS-CoV-2 infection
Published in Scientific reports (18-03-2021)“…A new and more aggressive strain of coronavirus, known as SARS-CoV-2, which is highly contagious, has rapidly spread across the planet within a short period of…”
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Computational Enzymology and Organophosphorus Degrading Enzymes: Promising Approaches Toward Remediation Technologies of Warfare Agents and Pesticides
Published in Current medicinal chemistry (01-01-2016)“…The re-emergence of chemical weapons as a global threat in hands of terrorist groups, together with an increasing number of pesticides intoxications and…”
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Silver(I) and Copper(II) 1,10-phenanthroline-5,6-dione complexes as promising antivirulence strategy against 'Leishmania': Focus on Gp63 (Leishmanolysin)
Published in Tropical medicine and infectious disease (30-06-2023)“…Leishmaniasis, caused by protozoa of the genus 'Leishmania', encompasses a group of neglected diseases with diverse clinical and epidemiological manifestations…”
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Molecular Docking, Metal Substitution and Hydrolysis Reaction of Chiral Substrates of Phosphotriesterase
Published in Combinatorial chemistry & high throughput screening (01-01-2016)“…During World War II, organophosphorus compounds with neurotoxic action were developed and used as the basis for the development of structures currently used as…”
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Assessing the Therapeutic and Toxicological Profile of Novel Acetylcholinesterase Reactivators: Value of In Silico And In Vitro Data
Published in Current medicinal chemistry (01-01-2023)“…Organophosphorus compounds (OP) make up an important class of inhibitors, mostly employed as pesticides, even as chemical weapons. These toxic substances act…”
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Identification of biotransformation products of disperse dyes with rat liver microsomes by LC-MS/MS and theoretical studies with DNA: Structure-mutagenicity relationship using Salmonella/microsome assay
Published in The Science of the total environment (01-02-2018)“…Azo dyes are known as a group of substances with DNA damage potential that depend on the nature and number of azo groups connected to aromatic rings (benzene…”
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Disarming Pseudomonas aeruginosa Virulence by the Inhibitory Action of 1,10-Phenanthroline-5,6-Dione-Based Compounds: Elastase B (LasB) as a Chemotherapeutic Target
Published in Frontiers in microbiology (02-08-2019)“…Elastase B (lasB) is a multifunctional metalloenzyme secreted by the gram-negative pathogen , and this enzyme orchestrates several physiopathological events…”
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A newly developed oxime K203 is the most effective reactivator of tabun-inhibited acetylcholinesterase
Published in BMC pharmacology & toxicology (21-02-2018)“…Based on in vitro and in vivo rat experiments, the newly developed acetylcholinesterase (AChE) reactivator, K203, appears to be much more effective in the…”
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Theoretical Studies Applied to the Evaluation of the DFPase Bioremediation Potential against Chemical Warfare Agents Intoxication
Published in International journal of molecular sciences (23-04-2018)“…Organophosphorus compounds (OP) are part of a group of compounds that may be hazardous to health. They are called neurotoxic agents because of their action on…”
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Understanding the Interaction Modes and Reactivity of Trimedoxime toward MmAChE Inhibited by Nerve Agents: Theoretical and Experimental Aspects
Published in International journal of molecular sciences (05-09-2020)“…Organophosphorus (OP) compounds are used as both chemical weapons and pesticides. However, these agents are very dangerous and toxic to humans, animals, and…”
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Trends in the Recent Patent Literature on Cholinesterase Reactivators (2016-2019)
Published in Biomolecules (Basel, Switzerland) (12-03-2020)“…Acetylcholinesterase (AChE) is the key enzyme responsible for deactivating the ACh neurotransmitter. Irreversible or prolonged inhibition of AChE, therefore,…”
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Future Therapeutic Perspectives into the Alzheimer's Disease Targeting the Oxidative Stress Hypothesis
Published in Molecules (Basel, Switzerland) (03-12-2019)“…Alzheimer's disease (AD) is a neurodegenerative disease that is usually accompanied by aging, increasingly being the most common cause of dementia in the…”
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Computational enzymology for degradation of chemical warfare agents: promising technologies for remediation processes
Published in AIMS microbiology (01-01-2017)“…Chemical weapons are a major worldwide problem, since they are inexpensive, easy to produce on a large scale and difficult to detect and control. Among the…”
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Combining computational tools and experimental studies towards endocrine disruptors mitigation: A review of biocatalytic and adsorptive processes
Published in Chemosphere (Oxford) (01-12-2023)“…The endocrine disruptors (EDCs) are an important group of emerging contaminants, and their mitigation has been a huge challenge due to their chemistry…”
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Influence of auxochrome group in disperse dyes bearing azo groups as chromophore center in the biotransformation and molecular docking prediction by reductase enzyme: Implications and assessment for environmental toxicity of xenobiotics
Published in Ecotoxicology and environmental safety (30-09-2018)“…Synthetic azo dyes have increasingly become a matter of great concern as a result of the genotoxic and mutagenic potential of the products derived from azo dye…”
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Development of technologies applied to the biodegradation of warfare nerve agents: Theoretical evidence for asymmetric homogeneous catalysis
Published in Chemico-biological interactions (01-08-2019)“…Organophosphorus compounds have been widely employed to the development of warfare nerve agents and pesticides, resulting in a huge number of people…”
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Experimental and theoretical affinity and catalysis studies between halogenated phenols and peroxidases: Understanding the bioremediation potential
Published in Ecotoxicology and environmental safety (01-10-2020)“…Halogenated phenols, such as 2,4-dichlorophenol (2,4-DCP) and 4-bromophenol (4-BP) are pollutants generated by a various industrial sectors like chemical, dye,…”
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Slight difference in the isomeric oximes K206 and K203 makes huge difference for the reactivation of organophosphorus-inhibited AChE: Theoretical and experimental aspects
Published in Chemico-biological interactions (25-08-2019)“…Studies with oximes have been extensively developed to design new reactivators with better efficiency, and greater spectrum of action. In this study, we aimed…”
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Biotransformation of disperse dyes using nitroreductase immobilized on magnetic particles modified with tosyl group: Identification of products by LC-MS-MS and theoretical studies conducted with DNA
Published in Environmental pollution (1987) (01-11-2018)“…The present work evaluates the action of nitroreductase enzyme immobilized on Tosylactivated magnetic particles (MP-Tosyl) on three disperse dyes which contain…”
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