Search Results - "Floriano, P."
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Key Topics in Molecular Docking for Drug Design
Published in International journal of molecular sciences (15-09-2019)“…Molecular docking has been widely employed as a fast and inexpensive technique in the past decades, both in academic and industrial settings. Although this…”
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Filtering promiscuous compounds in early drug discovery: is it a good idea?
Published in Drug discovery today (01-06-2016)“…•Computational filters for unspecific and promiscuous compounds are being disseminated in the literature.•Apparent promiscuity of certain chemical scaffolds…”
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De novo design and bioactivity prediction of SARS-CoV-2 main protease inhibitors using recurrent neural network-based transfer learning
Published in BMC chemistry (02-02-2021)“…The global pandemic of coronavirus disease (COVID-19) caused by SARS-CoV-2 (severe acute respiratory syndrome coronavirus 2) created a rush to discover drug…”
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Exploring the DNA binding/cleavage, cellular accumulation and topoisomerase inhibition of 2-hydroxy-3-(aminomethyl)-1,4-naphthoquinone Mannich bases and their platinum(II) complexes
Published in Journal of inorganic biochemistry (01-02-2013)“…Several chlorido and amino Pt2+ complexes of 2-hydroxy-3-(aminomethyl)-1,4-naphthoquinone Mannich bases HL exhibiting moderate to high cytotoxicity against…”
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On the three-finger protein domain fold and CD59-like proteins in Schistosoma mansoni
Published in PLoS neglected tropical diseases (01-10-2013)“…It is believed that schistosomes evade complement-mediated killing by expressing regulatory proteins on their surface. Recently, six homologues of human CD59,…”
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Synthesis, Biological Activity, and Molecular Modeling Studies of 1H-1,2,3-Triazole Derivatives of Carbohydrates as α-Glucosidases Inhibitors
Published in Journal of medicinal chemistry (25-03-2010)“…A class of drugs in use for treating type II diabetes mellitus (T2D), typified by the pseudotetrasaccharide acarbose, act by inhibiting the α-glucosidase…”
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Salivary and serum adiponectin and C‐reactive protein levels in acute myocardial infarction related to body mass index and oral health
Published in Journal of periodontal research (01-06-2017)“…Background and Objective Adiponectin is produced by adipose cells and is considered an anti‐inflammatory molecule. In contrast, C‐reactive protein (CRP) has…”
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Schistosomiasis Drug Discovery in the Era of Automation and Artificial Intelligence
Published in Frontiers in immunology (31-05-2021)“…Schistosomiasis is a parasitic disease caused by trematode worms of the genus and affects over 200 million people worldwide. The control and treatment of this…”
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Discovery of New Anti-Schistosomal Hits by Integration of QSAR-Based Virtual Screening and High Content Screening
Published in Journal of medicinal chemistry (11-08-2016)“…Schistosomiasis is a debilitating neglected tropical disease, caused by flatworms of Schistosoma genus. The treatment relies on a single drug, praziquantel…”
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Editorial: Current approaches in infectious disease drug discovery
Published in Frontiers in chemistry (30-11-2022)Get full text
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Hypoglycaemic activity of Bauhinia holophylla through GSK3-β inhibition and glycogenesis activation
Published in Pharmaceutical biology (01-01-2019)“…Context: Bauhinia L. species, including Bauhinia holophylla (Bong.) Steud. (Fabaceae), have traditionally been used to treat diabetes. Bauhinia is a complex…”
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Spirooxadiazoline‐oxindoles derived from imatinib show antimyeloproliferative potential in K562 cells
Published in Archiv der Pharmazie (Weinheim) (01-08-2024)“…Imatinib mesylate was the first representative BCR‐ABL1 tyrosine kinase inhibitor (TKI) class for the treatment of chronic myeloid leukemia. Despite the…”
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Neurological impairment caused by Schistosoma mansoni systemic infection exhibits early features of idiopathic neurodegenerative disease
Published in The Journal of biological chemistry (01-08-2021)“…Schistosomiasis, a neglected tropical disease caused by trematodes of the Schistosoma genus, affects over 250 million people around the world. This disease has…”
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QSAR-Driven Discovery of Novel Chemical Scaffolds Active against Schistosoma mansoni
Published in Journal of chemical information and modeling (25-07-2016)“…Schistosomiasis is a neglected tropical disease that affects millions of people worldwide. Thioredoxin glutathione reductase of Schistosoma mansoni (SmTGR) is…”
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Utility of Salivary Biomarkers for Demonstrating Acute Myocardial Infarction
Published in Journal of dental research (01-07-2014)“…The comparative utility of serum and saliva as diagnostic fluids for identifying biomarkers of acute myocardial infarction (AMI) was investigated. The goal was…”
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Data mart construction based on semantic annotation of scientific articles: A case study for the prioritization of drug targets
Published in Computer methods and programs in biomedicine (01-04-2018)“…•A new design methodology of Data Mart for unstructured data analysis by means of ontologies is proposed.•Design and load of a data mart with focus on gene…”
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Isolation and expression of a hypotensive and anti-platelet acidic phospholipase A2 from Bothrops moojeni snake venom
Published in Journal of pharmaceutical and biomedical analysis (25-01-2013)“…► BmooPLA2. ► An acidic phospholipase A2. ► Native and recombinant enzyme. ► Anti-platelet and hypotensive properties. ► Potential therapeutic agents. ►…”
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Journal Article Conference Proceeding -
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Screening of 1,2-furanonaphthoquinones 1,2,3-1H-triazoles for glycosidases inhibitory activity and free radical scavenging potential: an insight in anticancer activity
Published in Medicinal chemistry research (01-09-2019)“…In many cancer cells, glycoproteins show abnormal glycosylation patterns which have been associated with tumor initiation, progression, and metastasis. Thus,…”
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Enzymatic and structural characterization of a basic phospholipase A(2) from the sea anemone Condylactis gigantea
Published in Biochimie (01-08-2010)“…This work aimed at the isolation and structural/functional characterization of a phospholipase A(2) (CgPLA(2)) from the extract of the anemone Condylactis…”
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