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Structure-guided design of a perampanel-derived pharmacophore targeting the SARS-CoV-2 main protease

Structure(2021)10.1016/j.str.2021.06.002Source: DataRank Database

Structure-guided design of a perampanel-derived pharmacophore targeting the SARS-CoV-2 main protease is a research paper published in Structure (2021). On theSindex it has a DataRank of 0. It has been cited 63 times.

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Open Access63 citations

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datarank_citation_only_1hop_v6· scope data_onlyMethodology

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Enrichment:Funding (26 grants)OA: bronzeTopics (37)IDs (PubMed, PMC)Annotations (1)SDGs (1)

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Findable (1/2)

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Accessible (1/2)

Open Access

Interoperable (0/2)

Reusable (0/3)

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Authors (8)

Joseph A. Ippolito ORCID,Chunhui Zhang ORCID,Elizabeth A. Stone ORCID,R. Reilly ORCID,Scott J. Miller ORCID

Live enrichment

PubMed:34161756 PMC:PMC8218531

Biological and Environmental Research

Grant: KP1605010

Biological and Environmental Research

Grant: P30 GM124165

Biological and Environmental Research

Grant: S10OD021527

National Institutes of Health

Grant: AI087925

National Institutes of Health

Grant: GM32136

National Institutes of Health

Grant: R35 GM132092

National Institutes of Health

Grant: T32GM136651

Argonne National Laboratory

Grant: DE-AC02-06CH11357

Brookhaven National Laboratory

Grant: DE-SC0012704

National Institute of General Medical Sciences

Grant: P30GM133893

NIAID NIH HHS

Grant: R01 AI087925

NIGMS NIH HHS

Grant: R01 GM032136

NIGMS NIH HHS

Grant: T32 GM008283

NIGMS NIH HHS

Grant: T32 GM149438

National Institutes of Health

Grant: 5R01AI087925-07

Molecular determinants of hepatitis C virus assembly

National Institutes of Health

Grant: 5R35GM132092-03

Site-Selective Catalysis for Bioactive Scaffold Diversification

National Institutes of Health

Grant: 5P30GM133893-04

The Center for Biomolecular Structure at NSLS-II

National Institutes of Health

Grant: 3T32GM136651-02S2

Medical Scientist Training Program

National Institutes of Health

Grant: 3P30GM124165-03S1

NE-CAT: A Resource for Advanced Macromolecular Crystallography

National Institutes of Health

Grant: 2R01GM032136-25

Molecular Recognition of Proteins and Ligand Design

National Institutes of Health

Grant: 1S10OD021527-01

Pixel Array Detector for Macromolecular Crystallography

U.S. Department of Energy

National Science Foundation

Office of Science

Yale University

Office of Research Infrastructure Programs, National Institutes of Health

bronzeLicense: Elsevier Non-Commercial

publisherhttp://www.cell.com/article/S0969212621002069/pdf

publisherhttps://api.elsevier.com/content/article/PII:S0969212621002069?httpAccept=text/xml

publisherhttps://api.elsevier.com/content/article/PII:S0969212621002069?httpAccept=text/plain

repositoryhttps://www.osti.gov/biblio/1812110

repositoryhttps://www.osti.gov/biblio/1879931

Fields of Study

0301 basic medicine0303 health sciences03 medical and health sciences

MeSH Terms

NitrilesPyridonesProtease InhibitorsAntiviral AgentsMolecular StructureCatalytic DomainProtein ConformationDrug DesignProtein MultimerizationMolecular Dynamics SimulationCOVID-19SARS-CoV-2Coronavirus 3C ProteasesCOVID-19 Drug Treatment

Keywords

Drug designEnzyme kineticsX-ray crystallographyProtease inhibitorSars-cov-23Cl Main Protease3Cl M(pro)Molecular StructureProtein ConformationPyridonesCOVID-19Molecular Dynamics SimulationAntiviral AgentsArticleCOVID-19 Drug TreatmentCatalytic DomainNitrilesProtease InhibitorsProtein MultimerizationCoronavirus 3C Proteases

Sustainable Development Goals

SDG 3: 3. Good health