Search Results - "structure–activity relationship"

Deciphering Chemical Rules for Drug Penetration into Strongyloides by Miguel Marín, Javier Sánchez-Montejo, Sergio Ramos, Antonio Muro, Julio López-Abán, Rafael Peláez

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QSAR and molecular docking studies on designing potent inhibitors of SARS-CoVs main protease by Fucheng Song, Haoyang Sun, Xiaofang Ma, Wei Wang, Mingyuan Luan, Honglin Zhai, Guanmin Su, Yantao Liu

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Unravelling the potent anti-oxidant and anti-inflammatory actions of plumbagin: A review of preclinical discoveries by Aanchal Verma, Ahsas Goyal

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Application of machine learning to predict unbound drug bioavailability in the brain by J. Francisco Morales, J. Francisco Morales, M. Esperanza Ruiz, M. Esperanza Ruiz, Robert E. Stratford, Alan Talevi, Alan Talevi

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Design, synthesis, and structure–activity relationships of 2-benzylidene-1-indanone derivatives as anti-inflammatory agents for treatment of acute lung injury by Xiao S, Zhang W, Chen H, Fang B, Qiu Y, Chen X, Chen L, Shu S, Zhang Y, Zhao Y, Liu Z, Liang G

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3D-QSAR modeling and pharmacophore study of serotonin 5HT-₂A receptors antagonists by Antonijević Mirjana, Nikolić Katarina, Vučićević Jelica, Oljačić Slavica, Agbaba Danica

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Design, synthesis and biological evaluation of novel diosgenin-benzoic acid mustard hybrids with potential anti-proliferative activities in human hepatoma HepG2 cells by Jinling Zhang, Wenbao Wang, Yanzhao Tian, Liwei Ma, Lin Zhou, Hao Sun, Yukun Ma, Huiling Hou, Xiaoli Wang, Jin Ye, Xiaobo Wang

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Structural Modifications Yield Novel Insights Into the Intriguing Pharmacodynamic Potential of Anti-inflammatory Nitro-Fatty Acids by Nadine Hellmuth, Camilla Brat, Omar Awad, Omar Awad, Sven George, Astrid Kahnt, Tom Bauer, Hai Phong Huynh Phuoc, Dieter Steinhilber, Carlo Angioni, Mohamed Hassan, Mohamed Hassan, Katharina J. Hock, Georg Manolikakes, Kai Zacharowski, Jessica Roos, Jessica Roos, Thorsten J. Maier, Thorsten J. Maier

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Preclinical pharmacological profile of nomegestrol acetate, a synthetic 19-nor-progesterone derivative by van Diepen Harry A

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Hydrophobic Optimization of Functional Poly(TPAE-co-suberoyl chloride) for Extrahepatic mRNA Delivery following Intravenous Administration by Xueliang Yu, Shuai Liu, Qiang Cheng, Sang M. Lee, Tuo Wei, Di Zhang, Lukas Farbiak, Lindsay T. Johnson, Xu Wang, Daniel John Siegwart

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Natural Coumarin Derivatives Activating Nrf2 Signaling Pathway as Lead Compounds for the Design and Synthesis of Intestinal Anti-Inflammatory Drugs by Luiz C. Di Stasi

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Anticancer activity of THMPP: Downregulation of PI3K/ S6K1 in breast cancer cell line by Suresh Palanivel, Akshaya Murugesan, Olli Yli-Harja, Meenakshisundaram Kandhavelu

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Selective inhibitors of protozoan protein N-myristoyltransferases as starting points for tropical disease medicinal chemistry programs. by Andrew S Bell, James E Mills, Gareth P Williams, James A Brannigan, Anthony J Wilkinson, Tanya Parkinson, Robin J Leatherbarrow, Edward W Tate, Anthony A Holder, Deborah F Smith

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Development of the triazole-fused pyrimidine derivatives as highly potent and reversible inhibitors of histone lysine specific demethylase 1 (LSD1/KDM1A) by Zhonghua Li, Lina Ding, Zhongrui Li, Zhizheng Wang, Fengzhi Suo, Dandan Shen, Taoqian Zhao, Xudong Sun, Junwei Wang, Ying Liu, Liying Ma, Bing Zhao, Pengfei Geng, Bin Yu, Yichao Zheng, Hongmin Liu

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Cannabinoids as Antibacterial Agents: A Systematic and Critical Review of In Vitro Efficacy Against <i>Streptococcus</i> and <i>Staphylococcus</i> by Dhakshila Niyangoda, Myat Lin Aung, Mallique Qader, Wubshet Tesfaye, Mary Bushell, Fabian Chiong, Danny Tsai, Danish Ahmad, Indira Samarawickrema, Mahipal Sinnollareddy, Jackson Thomas

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Synthesis of Nitrostyrylthiazolidine-2,4-dione Derivatives Displaying Antileishmanial Potential by Omar Khoumeri, Sébastien Hutter, Nicolas Primas, Caroline Castera-Ducros, Sandra Carvalho, Susan Wyllie, Mohamed Lotfi Efrit, Dimitri Fayolle, Marc Since, Patrice Vanelle, Pierre Verhaeghe, Nadine Azas, Hussein El-Kashef

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Cytotoxic flavone-C-glycosides from the leaves of Dypsis pembana (H.E.Moore) Beentje & J.Dransf., Arecaceae: in vitro and molecular docking studies by Mohamed S. Abdelrahim, Afaf M. Abdel-Baky, Soad A. L. Bayoumi, Shaymaa M. Mohamed, Wael M. Abdel-Mageed, Enaam Y. Backheet

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Amino-3,5-Dicyanopyridines Targeting the Adenosine Receptors. Ranging from Pan Ligands to Combined A1/A2B Partial Agonists by Daniela Catarzi, Flavia Varano, Katia Varani, Fabrizio Vincenzi, Silvia Pasquini, Diego Dal Ben, Rosaria Volpini, Vittoria Colotta

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Antistaphylococcal Activities and ADME-Related Properties of Chlorinated Arylcarbamoylnaphthalenylcarbamates by Tomas Gonec, Dominika Pindjakova, Lucia Vrablova, Tomas Strharsky, Hana Michnova, Tereza Kauerova, Peter Kollar, Michal Oravec, Izabela Jendrzejewska, Alois Cizek, Josef Jampilek

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Novel 3,4-Dihydroisocoumarins Inhibit Human P-gp and BCRP in Multidrug Resistant Tumors and Demonstrate Substrate Inhibition of Yeast Pdr5 by Julia Sachs, Katja Döhl, Anja Weber, Michele Bonus, Ferdinand Ehlers, Edmond Fleischer, Anette Klinger, Holger Gohlke, Holger Gohlke, Jörg Pietruszka, Jörg Pietruszka, Lutz Schmitt, Nicole Teusch

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