Search Results - "Maltarollo, Vinícius G"

Recent Advances in the Prediction of Pharmacokinetics Properties in Drug Design Studies: A Review by Pantaleão, Simone Q., Fernandes, Philipe O., Gonçalves, José Eduardo, Maltarollo, Vinícius G., Honorio, Kathia Maria

“…This review presents the main aspects related to pharmacokinetic properties, which are essential for the efficacy and safety of drugs. This topic is very…”
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Identifying structural features related to the biological activity of a series of AT1 antagonists from fragment-based drug design by da C Silva, Danielle, Maltarollo, Vinícius G, Honorio, Kathia M

“…Antagonists of AT1 receptor are interesting substances to develop drugs that can be used for the treatment of hypertension and other diseases that affect the…”
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Structure-guided drug design targeting Abl kinase: how structure and regulation can assist in designing new drugs by Martins, Diego M, Fernandes, Philipe O, Vieira, Lucas A, Maltarollo, Vinícius G, Moraes, Adolfo Henrique

“…The human protein Abelson kinase (Abl), a tyrosine kinase, plays a pivotal role in developing chronic myeloid leukemia (CML). Abl's involvement in various…”
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Do Drug‐likeness Rules Apply to Oral Prodrugs? by Protti, Ícaro F., Rodrigues, Daniel R., Fonseca, Sofia K., Alves, Ricardo J., Oliveira, Renata B., Maltarollo, Vinícius G.

“…This paper describes a comparative analysis of the physicochemical and structural properties of prodrugs and their corresponding drugs with regard to…”
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A mosaic-structured framework applied in the healthy food design: insights from integrated in silico and in vitro approaches by Azevedo, Luciana, Granato, Daniel, Maltarollo, Vinícius G, Gonçalves, José E

“…Agrifood system technologies have enabled the development of novel foods with enhanced nutritional composition. Herein, we provide an overview of food…”
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Synthesis, design, and optimization of a potent and selective series of pyridylpiperazines as promising antimalarial agents by da Silva Oliveira, Douglas Davison, Paz, Franciarli, Brito, Nícolas Peterson Ferreira, Krüger, Arne, Martinho, Ana Clara Cassiano, Lapierre, Thibault Joseph William Jacques Dit, de Oliveira Souza, Felipe, Maltarollo, Vinícius G., Kronenberger, Thales, Mendes, Marina Sena, Nonato, Maria Cristina, Pilau, Eduardo Jorge, Wrenger, Carsten, Wunderlich, Gerhard, Rezende Júnior, Celso de Oliveira

“…An optimization of the pyridylpiperazine series against Plasmodium falciparum has been performed, exploring a structure-activity relationship carried out on…”
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Advances and Perspectives in Applying Deep Learning for Drug Design and Discovery by Lipinski, Celio F, Maltarollo, Vinicius G, Oliveira, Patricia R, da Silva, Alberico B F, Honorio, Kathia Maria

“…Discovering (or planning) a new drug candidate involves many parameters, which makes this process slow, costly, and leading to failures at the end in some…”
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Improving the solubility of an antifungal thiazolyl hydrazone derivative by cyclodextrin complexation by Silva, Iara R., Kronenberger, Thales, Gomes, Elionai C.L., César, Isabela C., Oliveira, Renata B., Maltarollo, Vinícius G.

“…RN104, named 2-[2-(cyclohexylmethylene)hydrazinyl)]-4-phenylthiazole, is a thiazolyl hydrazone derivative with promising antifungal activity. A HPLC-DAD method…”
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In silico evaluation of pharmacokinetics properties of withanolides and simulation of their biological activities against Alzheimer's disease by Dutra, Luana L., Borges, Rafael J., Maltarollo, Vinícius G., Mendes, Tiago A. O., Bressan, Gustavo C., Leite, João Paulo V.

“…The withanolides are naturally occurring steroidal lactones found mainly in plants of the Solanaceae family. The subtribe Withaninae includes species like…”
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Structure-Based Virtual Screening, Molecular Dynamics and Binding Free Energy Calculations of Hit Candidates as ALK-5 Inhibitors by Araujo, Sheila C, Maltarollo, Vinicius G, Almeida, Michell O, Ferreira, Leonardo L G, Andricopulo, Adriano D, Honorio, Kathia M

“…Activin-like kinase 5 (ALK-5) is involved in the physiopathology of several conditions, such as pancreatic carcinoma, cervical cancer and liver hepatoma…”
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Structure-based virtual screening and discovery of New PPARδ/γ dual agonist and PPARδ and γ agonists by Maltarollo, Vinicius G, Togashi, Marie, Nascimento, Alessandro S, Honorio, Kathia M

“…Peroxisome proliferator-activated receptors (PPARs) are involved in the control of carbohydrate and lipid metabolism and are considered important targets to…”
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Hologram QSAR studies of antiprotozoal activities of sesquiterpene lactones by Trossini, Gustavo H G, Maltarollo, Vinícius G, Schmidt, Thomas J

“…Infectious diseases such as trypanosomiasis and leishmaniasis are considered neglected tropical diseases due the lack for many years of research and…”
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GQ-11: A new PPAR agonist improves obesity-induced metabolic alterations in LDLr−/− mice by Silva, Jacqueline C., de Oliveira, Edson M., Turato, Walter M., Trossini, Gustavo H. G., Maltarollo, Vinícius G., Pitta, Marina G. R., Pitta, Ivan R., de las Heras, Beatriz, Boscá, Lisardo, Rudnicki, Martina, Abdalla, Dulcineia S. P.

“…Background Obesity and insulin resistance/diabetes are important risk factors for cardiovascular diseases and demand safe and efficacious therapeutics…”
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BbMP-1, a new metalloproteinase isolated from Bothrops brazili snake venom with in vitro antiplasmodial properties by Kayano, Anderson M., Simões-Silva, Rodrigo, Medeiros, Patrícia S.M., Maltarollo, Vinícius G., Honorio, Kathia M., Oliveira, Eliandre, Albericio, Fernando, da Silva, Saulo L., Aguiar, Anna Caroline C., Krettli, Antoniana U., Fernandes, Carla F.C., Zuliani, Juliana P., Calderon, Leonardo A., Stábeli, Rodrigo G., Soares, Andreimar M.

“…This study describes the biochemical and functional characterization of a new metalloproteinase named BbMP-1, isolated from Bothrops brazili venom. BbMP-1 was…”
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Antibacterial activity of synthetic 1,3‐bis(aryloxy)propan‐2‐amines against Gram‐positive bacteria by Serafim, Mateus S. M., Lavorato, Stefânia N., Kronenberger, Thales, Sousa, Yamara V., Oliveira, Graziele P., dos Santos, Simone G., Kroon, Erna G., Maltarollo, Vinícius G., Alves, Ricardo J., Mota, Bruno E. F.

“…Synthetic 1,3‐bis(aryloxy)propan‐2‐amines have been shown in previous studies to possess several biological activities, such as antifungal and antiprotozoal…”
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Synthesis of quinoline derivatives as potential cysteine protease inhibitors by Andrade, Marina Ms, Martins, Luan C, Marques, Gabriel Vl, Silva, Carla A, Faria, Gilson, Caldas, Sérgio, Dos Santos, Janete Sc, Leclercq, Sophie Y, Maltarollo, Vinícius G, Ferreira, Rafaela S, Oliveira, Renata B

“…Cysteine proteases are important molecular targets involved in the replication, virulence and survival of parasitic organisms, including and species. Analogs…”
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Transfer and Multi-task Learning in QSAR Modeling: Advances and Challenges by Simões, Rodolfo S, Maltarollo, Vinicius G, Oliveira, Patricia R, Honorio, Kathia M

“…Medicinal chemistry projects involve some steps aiming to develop a new drug, such as the analysis of biological targets related to a given disease, the…”
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Benchmark studies of UV–vis spectra simulation for cinnamates with UV filter profile by Garcia, Ricardo D’A., Maltarollo, Vinícius G., Honório, Káthia M., Trossini, Gustavo H. G.

“…Skin cancer is a serious public health problem worldwide, being incident over all five continents and affecting an increasing number of people. As sunscreens…”
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Synthesis of arylfuran derivatives as potential antibacterial agents by Andrade, Marina M. S., Protti, Ícaro F., Maltarollo, Vinícius G., da Costa, Ygor F. G., de Moraes, Wesley G., Moreira, Nicole F., Garcia, Giovana G., Caran, Gabriel F., Ottoni, Flaviano M., Alves, Ricardo J., Moreira, Carolina P. S., Martins, Helen R., Alves, Maria Silvana, de Oliveira, Renata B.

“…Bacterial infections represent a serious health care problem mainly due to the misuse and overuse of antibiotics, with consequent emergence of multidrug…”
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Application of bioisosterism in design of the semicarbazone derivatives as cruzain inhibitors: a theoretical and experimental study by Vital, Drielli G., Damasceno, Flávia S., Rapado, Ludmila N., Silber, Ariel M., Vilella, Filipe S., Ferreira, Rafaela S., Maltarollo, Vinícius G., Trossini, Gustavo H. G.

“…A series of semicarbazone, thiosemicarbazone, and aminoguanidine derivatives were synthesized and tested as antitrypanosomal agents. The theoretical NMR of the…”
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