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Extensive Crystallographic Fragment-Based Approach to Design SARS CoV2 3CLpro Main Protease Inhibitors and Related Metadata

Sarfraz Ahmad, Iskandar Abdullah, Yean Kee Lee, Mamoona Nazir, Muhammad Usman Mirza, John F. Trant, Noorsaadah Binti Abd Rahman

Version 1 posted 11 January 2021

589

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1

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Biological and Medicinal Chemistry

Working Paper

Identification of β-Strand Mediated Protein-Protein Interaction Inhibitors Using Ligand-Directed Fragment Ligation

Zsófia Hegedüs Zsófia Hegedüs, Fruzsina Hobor, Deborah K. Shoemark, sergio Celis, Lu-Yun Lian, Chi Trinh, Richard Sessions, Thomas Edwards, Andrew Wilson

Version 1 posted 05 June 2020

529

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Biological and Medicinal Chemistry

Working Paper

Development of Inhibitors Against Mycobacterium Abscessus tRNA (m1G37) Methyltransferase (TrmD) Using Fragment-Based Approaches

Andrew J. Whitehouse, Sherine E. Thomas, Karen P. Brown, Alexander Fanourakis, Daniel Chan, M. Daben J. Libardo, Vitor Mendes, Helena I. M. Boshoff, R. Andres Floto, Chris Abell, Tom. L. Blundell, Anthony Coyne

Version 1 posted 16 May 2019

590

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Biological and Medicinal Chemistry

Review

Fragment-based approaches to identify RNA binders

Blessy M. Suresh, Amirhossein Taghavi, Jessica L. Childs-Disney, Matthew D. Disney

Version 1 posted 13 January 2023

727

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Biological and Medicinal Chemistry

Working Paper

Reversible Small Molecule pan-Ras Inhibitors Display Tunable Affinity for the Active and Inactive forms of Ras.

Charles Parry, Francesca Pellicano, Alexander W. Schüttelkopf, Kim Beyer, Justin Bower, Amy Bryson, Kenneth S. Cameron, Nichole M. Cerutti, Jonathan P. Clark, Stuart Davidson, Keneth Davies, Martin J. Drysdale, Jeffrey Engelman, Anna Estevan-Barber, Andrea Gohlke, Christopher H. Gray, Daniel A. Guthy, Min Hong, Alana Hopkins, Luke Hutchinson, Jennifer Konczal, Michel Maira, Duncan McArthur, Mokdad Mezna, Heather McKinnon, Ridvan Nepravishta, Nils Ostermann, Camila Pasquali, Katie Pollock, Angelo Pugliese, Nicholas Rooney, Niko Schmiedeberg, Paul Shaw, Camilo Velez-Vega, Christopher West, Ryan West, Frederic Zecri, John B. Taylor

Version 2 posted 14 November 2024

1,022

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Physical Chemistry

Working Paper

Micromolar concentration affinity study on a benchtop NMR spectrometer with secondary 13C labeled hyperpolarized ligands

Olivier Cala, Charlotte Bocquelet, Chloé Gioiosa, Felix Torres, Samuel F. Cousin, Sylvie Guibert, Morgan Ceillier, Venita Busse, Frank Decker, James G. Kempf, Stuart J. Elliott, Quentin Stern, Aurélien Bornet, Sami Jannin

Version 2 posted 05 September 2024

346

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Catalysis

Working Paper

Accessing active fragments for drug discovery utilising nitroreductase biocatalysis

Lauren Holder, Eda Yuce, Gabriel Oriomah, Aimee Jenkins, Jóhannes Reynisson, Anja Winter, Sebastian Cosgrove

Version 1 posted 12 March 2024

306

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Biological and Medicinal Chemistry

Working Paper

Expanding Bioactive Fragment Space with the Generated Database GDB-13s

Ye Buehler, Jean-Louis Reymond

Version 1 posted 19 July 2023

198

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Biological and Medicinal Chemistry

Working Paper

Design and Crystallographic Screening of a Highly Sociable and Diverse Fragment Library Towards Novel Antituberculotic Drugs

Philipp Janssen, Fabrice Becker, Friederike T. Füsser, Nataliya Tolmachova, Tetiana Matviiuk, Ivan Kondratov, Manfred Weiss, Daniel Kümmel, Oliver Koch

Version 2 posted 09 September 2024

159

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Biological and Medicinal Chemistry

Working Paper

A Formylglycine-Peptide for the Site-Directed Identification of Phosphotyrosine-Mimetic Fragments

Markus Tiemann, Eric Nawrotzky, Peter Schmieder, Leon Wehrhan, Silke Bergemann, Vera Martos, Christoph Arkona, Bettina G. Keller, Jörg Rademann

Version 1 posted 08 April 2022

228

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Refine Search

14 results in fragment-based drug discovery in Keywords: fragment-based drug discovery

Extensive Crystallographic Fragment-Based Approach to Design SARS CoV2 3CLpro Main Protease Inhibitors and Related Metadata

Identification of β-Strand Mediated Protein-Protein Interaction Inhibitors Using Ligand-Directed Fragment Ligation

Development of Inhibitors Against Mycobacterium Abscessus tRNA (m1G37) Methyltransferase (TrmD) Using Fragment-Based Approaches

Fragment-based approaches to identify RNA binders

Reversible Small Molecule pan-Ras Inhibitors Display Tunable Affinity for the Active and Inactive forms of Ras.

Micromolar concentration affinity study on a benchtop NMR spectrometer with secondary 13C labeled hyperpolarized ligands

Accessing active fragments for drug discovery utilising nitroreductase biocatalysis

Expanding Bioactive Fragment Space with the Generated Database GDB-13s

Design and Crystallographic Screening of a Highly Sociable and Diverse Fragment Library Towards Novel Antituberculotic Drugs

A Formylglycine-Peptide for the Site-Directed Identification of Phosphotyrosine-Mimetic Fragments

14 results in Keywords: fragment-based drug discovery