Comprehensive Fragment Screening of the SARS‐CoV‐2 Proteome Explores Novel Chemical Space for Drug Development

Author:

Berg Hannes12ORCID,Wirtz Martin Maria A.12ORCID,Altincekic Nadide12ORCID,Alshamleh Islam12ORCID,Kaur Bains Jasleen12,Blechar Julius1,Ceylan Betül12,de Jesus Vanessa12,Dhamotharan Karthikeyan23ORCID,Fuks Christin1,Gande Santosh L.12,Hargittay Bruno12,Hohmann Katharina F.12,Hutchison Marie T.12,Marianne Korn Sophie23ORCID,Krishnathas Robin12,Kutz Felicitas12,Linhard Verena12,Matzel Tobias12,Meiser Nathalie1,Niesteruk Anna12,Pyper Dennis J.12,Schulte Linda12ORCID,Trucks Sven1,Azzaoui Kamal4,Blommers Marcel J. J.4,Gadiya Yojana56,Karki Reagon56,Zaliani Andrea56,Gribbon Philip56,da Silva Almeida Marcius76ORCID,Dinis Anobom Cristiane89,Bula Anna L.10,Bütikofer Matthias11,Putinhon Caruso Ícaro712,Caterina Felli Isabella1314ORCID,Da Poian Andrea T.7,Cardoso de Amorim Gisele715,Fourkiotis Nikolaos K.16ORCID,Gallo Angelo1617ORCID,Ghosh Dhiman11,Gomes‐Neto Francisco818,Gorbatyuk Oksana19,Hao Bing19,Kurauskas Vilius20,Lecoq Lauriane21,Li Yunfeng19,Cunha Mebus‐Antunes Nathane7,Mompeán Miguel22,Cristtina Neves‐Martins Thais7,Ninot‐Pedrosa Martí21ORCID,Pinheiro Anderson S.9,Pontoriero Letizia1314ORCID,Pustovalova Yulia19,Riek Roland11,Robertson Angus J.23,Jose Abi Saad Marie24,Treviño Miguel Á.22ORCID,Tsika Aikaterini C.16ORCID,Almeida Fabio C. L.78ORCID,Bax Ad23ORCID,Henzler‐Wildman Katherine20ORCID,Hoch Jeffrey C.19ORCID,Jaudzems Kristaps10ORCID,Laurents Douglas V.22ORCID,Orts Julien24,Pierattelli Roberta1314,Spyroulias Georgios A.16,Duchardt‐Ferner Elke23,Ferner Jan12ORCID,Fürtig Boris12,Hengesbach Martin1ORCID,Löhr Frank23ORCID,Qureshi Nusrat12ORCID,Richter Christian12ORCID,Saxena Krishna12,Schlundt Andreas23ORCID,Sreeramulu Sridhar12,Wacker Anna12,Weigand Julia E.25ORCID,Wirmer‐Bartoschek Julia12ORCID,Wöhnert Jens23,Schwalbe Harald12ORCID

Affiliation:

1. Institute for Organic Chemistry and Chemical Biology Goethe University Frankfurt 60438 Frankfurt am Main Germany

2. Center of Biomolecular Magnetic Resonance (BMRZ) Goethe University Frankfurt, Frankfurt am Main (Germany) Max-von-LaueStrasse 7+9 60438 Frankfurt am Main Germany

3. Institute for Molecular Biosciences Goethe University Frankfurt Max-von-Laue Strasse 7+9 60438 Frankfurt am Main Germany

4. Saverna Therapeutics Pumpmattenweg 3 4105 Biel-Benken Switzerland

5. Fraunhofer Institute for Translational Medicine and Pharmacology (ITMP) Screening Port Schnackenburgallee 114 22525 Hamburg Germany

6. Fraunhofer Cluster of Excellence for Immune-Mediated Diseases (CIMD) Theodor-Stern-Kai 7 60596 Frankfurt am Main Germany

7. Institute of Medical Biochemistry Federal University of Rio de Janeiro 21941-902 Rio de Janeiro Brazil

8. National Center of Nuclear Magnetic Resonance (CNRMN), CENABIO Federal University of Rio de Janeiro 21941-902 Rio de Janeiro Brazil

9. Department of Biochemistry Institute of Chemistry Federal University of Rio de Janeiro 21941-902 Rio de Janeiro Brazil

10. Latvian Institute of Organic Synthesis Aizkraukles 21 LV-1006 Riga Latvia

11. ETH Swiss Federal Institute of Technology Laboratory of Physical Chemistry, HCI F217 Vladimir-Prelog-Weg 2 8093 Zürich Switzerland

12. Multiuser Center for Biomolecular Innovation (CMIB) Department of Physics São Paulo State University (UNESP) 01049-010 São José do Rio Preto Brazil

13. Magnetic Resonance Center (CERM) University of Florence Via Luigi Sacconi 6, Sesto Fiorentino 50019 Florence Italy

14. Department of Chemistry “Ugo Schiff” University of Florence Via della Lastruccia 3-13, Sesto Fiorentino 50019 Florence Italy

15. Multidisciplinary Center for Research in Biology (NUMPEX) Campus Duque de Caxias Federal University of Rio de Janeiro 25.250-470 Duque de Caxias Brazil

16. Department of Pharmacy University of Patras 26504 Patras Greece

17. Department of Chemistry University of Torino IT−10126 Torino Italy

18. Laboratory of Toxinology Oswaldo Cruz Foundation (FIOCRUZ) 21040-900 Rio de Janeiro Brazil

19. Department of Molecular Biology and Biophysics UConn Health 263 Farmington Ave. Farmington CT 06030-3305 USA

20. Department of Biochemistry University of Wisconsin-Madison Madison WI 53706 USA

21. Molecular Microbiology and Structural Biochemistry UMR5086 CNRS/Université Lyon 1 7, passage du Vercors 69367 Lyon France

22. “Rocasolano” Institute for Physical Chemistry CSIC 28006 Madrid Spain

23. Laboratory of Chemical Physics National Institute of Diabetes and Digestive and Kidney 20892-0520 Bethesda USA

24. University of Vienna Department of Pharmaceutical Sciences Josef-Holaubek-Platz 2 A-1090 Vienna Austria

25. Department of Biology Technical University of Darmstadt 64289 Darmstadt Germany

Funder

Hessisches Ministerium für Wissenschaft und Kunst

Deutsche Forschungsgemeinschaft

H2020 Research Infrastructures

H2020 Future and Emerging Technologies

FP7 Research Potential of Convergence Regions

Key Laboratory of Dynamic Cognitive System of Electromagnetic Spectrum Space

Fondazione Cassa di Risparmio di Firenze

Agence Nationale de la Recherche

National Institutes of Health

National Science Foundation

Latvijas Zinātnes Padome

Krebsliga Schweiz

Schweizerischer Nationalfonds zur Förderung der Wissenschaftlichen Forschung

Publisher

Wiley

Subject

General Chemistry,Catalysis

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