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Deep Alanine Scanning Reveals Potent Multi-alanine-substituted Protein–protein Interaction Inhibitors

Xiyun Ye, Yen-Chun Lee, Zachary P. Gates, Yingjie Ling, Jennifer Mortensen, Fan-Shen Yang, Yu-Shan Lin, Bradley Pentelute

Version 1 posted 21 January 2021

784

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1

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Theoretical and Computational Chemistry

Working Paper

Cheminformatics Modeling of Closantel Analogues for Treating River Blindness

Melaine A. Kuenemann, Phyo Phyo Zin, Sravya Kuchibhotla, Denis Fourches

Version 1 posted 17 January 2020

491

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Biological and Medicinal Chemistry

Working Paper

Role of Guanidinium-Carboxylate Interaction in Enzyme Inhibition with Implication for Drug Design

Aswathy Muttathukattil, Sriraksha Srinivasan, Antarip Halder, Govardhan Reddy

Version 1 posted 02 July 2019

491

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Biological and Medicinal Chemistry

Working Paper

Improvement of Inhibitors of the Macrophage Infectivity Potentiator Protein from Trypanosoma cruzi, Burkholderia pseudomallei, and Legionella pneumophila – a Comparison

Theresa Lohr, Carina Herbst, Nicole Bzdyl, Christopher Jenkins, Nicolas Scheuplein, Wisely Oki Sugiarto, Jacob Whittaker, Albert Guskov, Isobel Norville, Ute Hellmich, Felix Hausch, Mitali Sakar-Tyson, Christoph Sotriffer, Ulrike Holzgrabe

Version 1 posted 27 May 2024

81

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Organic Chemistry

Working Paper

Identification of a privileged scaffold for inhibition of sterol transport proteins through the synthesis and ring distortion of diverse, pseudo-natural products

Frederik Simonsen Bro, Laura Depta, Nienke Dekker, Hogan Bryce-Rogers, Kaia Præstegaard, Tino Petersson, Thomas Whitmarsh-Everiss, Mariusz Kubus, Luca Laraia

Version 1 posted 24 July 2024

270

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Biological and Medicinal Chemistry

Working Paper

Selective Carbonic Anhydrase IX and XII Inhibitors Based Around a Functionalized Coumarin Scaffold

Bader Huwaimel, Sravan Jonnalagadda, Shirisha Jonnalagadda, Shikha Kumari, Alessio Nocentinic, Claudiu Supuran, Trippier Paul

Version 1 posted 30 January 2023

204

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Biological and Medicinal Chemistry

Working Paper

Assessing the activity of benzodioxol, phenol and aniline derivatives as radical trapping antioxidants that inhibit ferroptosis

Helene B. E. Schricker, Mohamed M. Mouzayek, Jonas Wanninger, Hala Zahran, Kyra Lützel, Anna V. Milton, Eikan Mishima, Toshitaka Nakamura, Bettina Proneth, Marcus Conrad, David B. Konrad

Version 1 posted 28 March 2024

424

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Biological and Medicinal Chemistry

Working Paper

A photo-SAR study of photoswitchable azobenzene tubulin-inhibiting antimitotics identifying a general method for near-quantitative photocontrol

Martin Reynders, Małgorzata Garścia, Adrian Müller-Deku, Maximilian Wranik, Kristina Krauskopf, Luis de la Osa de la Rosa, Konstantin Schaffer, Anna Jötten, Alexander Rode, Valentin Stierle, Yvonne Kraus, Benedikt Baumgartner, Ahmed Ali, Andrei Bubeneck, Trina Seal, Michel Steinmetz, Philipp Paulitschke, Oliver Thorn-Seshold

Version 1 posted 08 May 2024

147

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Biological and Medicinal Chemistry

Working Paper

Comprehensive cell biological investigation of cytochalasin B derivatives with distinct activities on the actin network

Mervic D. Kagho, Katharina Schmidt, Christopher Lambert, Thomas Kaufmann, Lili Jia, Jan Faix, Klemens Rottner, Marc Stadler, Theresia Stradal, Philipp Klahn

Version 2 posted 24 June 2024

245

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Catalysis

Working Paper

Data-driven Workflow for the Development and Discovery of N-oxyl Hydrogen Atom Transfer Catalysts

Cheng Yang, Thérèse Wild, Yulia Rakova, Stephen Maldonado, Matthew Sigman, Corey Stephenson

Version 1 posted 28 October 2024

488

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Refine Search

22 results in Structure-activity relationship in Keywords: Structure-activity relationship

Deep Alanine Scanning Reveals Potent Multi-alanine-substituted Protein–protein Interaction Inhibitors

Cheminformatics Modeling of Closantel Analogues for Treating River Blindness

Role of Guanidinium-Carboxylate Interaction in Enzyme Inhibition with Implication for Drug Design

Improvement of Inhibitors of the Macrophage Infectivity Potentiator Protein from Trypanosoma cruzi, Burkholderia pseudomallei, and Legionella pneumophila – a Comparison

Identification of a privileged scaffold for inhibition of sterol transport proteins through the synthesis and ring distortion of diverse, pseudo-natural products

Selective Carbonic Anhydrase IX and XII Inhibitors Based Around a Functionalized Coumarin Scaffold

Assessing the activity of benzodioxol, phenol and aniline derivatives as radical trapping antioxidants that inhibit ferroptosis

A photo-SAR study of photoswitchable azobenzene tubulin-inhibiting antimitotics identifying a general method for near-quantitative photocontrol

Comprehensive cell biological investigation of cytochalasin B derivatives with distinct activities on the actin network

Data-driven Workflow for the Development and Discovery of N-oxyl Hydrogen Atom Transfer Catalysts

22 results in Keywords: Structure-activity relationship