Ultralarge Virtual Screening Identifies SARS-CoV-2 Main Protease Inhibitors with Broad-Spectrum Activity against Coronaviruses

Author:

Luttens Andreas1ORCID,Gullberg Hjalmar2,Abdurakhmanov Eldar3,Vo Duy Duc1,Akaberi Dario4ORCID,Talibov Vladimir O.5,Nekhotiaeva Natalia2,Vangeel Laura67,De Jonghe Steven67ORCID,Jochmans Dirk67,Krambrich Janina4,Tas Ali8,Lundgren Bo2,Gravenfors Ylva9ORCID,Craig Alexander J.10,Atilaw Yoseph11,Sandström Anja10,Moodie Lindon W. K.1012ORCID,Lundkvist Åke4,van Hemert Martijn J.8,Neyts Johan67,Lennerstrand Johan13,Kihlberg Jan11ORCID,Sandberg Kristian101415,Danielson U. Helena3ORCID,Carlsson Jens1ORCID

Affiliation:

1. Science for Life Laboratory, Department of Cell and Molecular Biology, Uppsala University, SE-75124 Uppsala, Sweden

2. Science for Life Laboratory, Biochemical and Cellular Assay Facility, Drug Discovery and Development Platform, Department of Biochemistry and Biophysics, Stockholm University, Solna, SE-17121 Stockholm, Sweden

3. Science for Life Laboratory, Department of Chemistry-BMC, Uppsala University, SE-75123 Uppsala, Sweden

4. Department of Medical Biochemistry and Microbiology, Zoonosis Science Center, Uppsala University, SE-75123 Uppsala, Sweden

5. BioMax beamline, MAX IV Laboratory, Fotongatan 2, SE-22484 Lund, Sweden

6. KU Leuven, Department of Microbiology, Immunology and Transplantation, Rega Institute, Laboratory of Virology and Chemotherapy, 3000 Leuven, Belgium

7. Global Virus Network, Baltimore, Maryland 21201, United States

8. Department of Medical Microbiology, Leiden University Medical Center, 2333ZA Leiden, The Netherlands

9. Science for Life Laboratory, Drug Discovery & Development Platform, Department of Organic Chemistry, Stockholm University, Solna, SE-17121 Stockholm, Sweden

10. Department of Medicinal Chemistry, Uppsala University, SE-75123 Uppsala, Sweden

11. Department of Chemistry-BMC, Uppsala University, SE-75123 Uppsala, Sweden

12. Uppsala Antibiotic Centre, Uppsala University, SE-75123 Uppsala, Sweden

13. Department of Medical Sciences, Section of Clinical Microbiology, Uppsala University, SE-75185 Uppsala, Sweden

14. Department of Physiology and Pharmacology, Karolinska Institutet, SE-17177 Stockholm, Sweden

15. Science for Life Laboratory, Drug Discovery & Development Platform, Uppsala Biomedical Center, Uppsala University, SE-75123 Uppsala, Sweden

Funder

Svenska Forskningsrådet Formas

Herculesstichting

Vetenskapsrådet

KU Leuven

Rega Foundation

VINNOVA

Knut och Alice Wallenbergs Stiftelse

Carl Tryggers Stiftelse för Vetenskaplig Forskning

Fonds Wetenschappelijk Onderzoek

H2020 European Research Council

UZ Leuven

Publisher

American Chemical Society (ACS)

Subject

Colloid and Surface Chemistry,Biochemistry,General Chemistry,Catalysis

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