A Workflow of Integrated Resources to Catalyze Network Pharmacology Driven COVID-19 Research.


Journal

bioRxiv : the preprint server for biology
Titre abrégé: bioRxiv
Pays: United States
ID NLM: 101680187

Informations de publication

Date de publication:
05 Nov 2020
Historique:
entrez: 11 11 2020
pubmed: 12 11 2020
medline: 12 11 2020
Statut: epublish

Résumé

In the event of an outbreak due to an emerging pathogen, time is of the essence to contain or to mitigate the spread of the disease. Drug repositioning is one of the strategies that has the potential to deliver therapeutics relatively quickly. The SARS-CoV-2 pandemic has shown that integrating critical data resources to drive drug-repositioning studies, involving host-host, hostpathogen and drug-target interactions, remains a time-consuming effort that translates to a delay in the development and delivery of a life-saving therapy. Here, we describe a workflow we designed for a semi-automated integration of rapidly emerging datasets that can be generally adopted in a broad network pharmacology research setting. The workflow was used to construct a COVID-19 focused multimodal network that integrates 487 host-pathogen, 74,805 host-host protein and 1,265 drug-target interactions. The resultant Neo4j graph database named "Neo4COVID19" is accessible via a web interface and via API calls based on the Bolt protocol. We believe that our Neo4COVID19 database will be a valuable asset to the research community and will catalyze the discovery of therapeutics to fight COVID-19. https://neo4covid19.ncats.io.

Identifiants

pubmed: 33173863
doi: 10.1101/2020.11.04.369041
pmc: PMC7654851
pii:
doi:

Types de publication

Preprint

Langues

eng

Commentaires et corrections

Type : UpdateIn

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Auteurs

Gergely Zahoránszky-Kőhalmi (G)

National Center for Advancing Translational Sciences, Rockville, MD, USA.

Vishal B Siramshetty (VB)

National Center for Advancing Translational Sciences, Rockville, MD, USA.

Praveen Kumar (P)

Department of Internal Medicine, University of New Mexico School of Medicine, Albuquerque, NM, USA.
Department of Computer Science, University of New Mexico, Albuquerque, New Mexico, USA.

Manideep Gurumurthy (M)

National Center for Advancing Translational Sciences, Rockville, MD, USA.

Busola Grillo (B)

National Center for Advancing Translational Sciences, Rockville, MD, USA.

Biju Mathew (B)

National Center for Advancing Translational Sciences, Rockville, MD, USA.

Dimitrios Metaxatos (D)

National Center for Advancing Translational Sciences, Rockville, MD, USA.

Mark Backus (M)

National Center for Advancing Translational Sciences, Rockville, MD, USA.

Tim Mierzwa (T)

National Center for Advancing Translational Sciences, Rockville, MD, USA.

Reid Simon (R)

National Center for Advancing Translational Sciences, Rockville, MD, USA.

Ivan Grishagin (I)

National Center for Advancing Translational Sciences, Rockville, MD, USA.
Rancho BioSciences LLC., San Diego, CA USA.

Laura Brovold (L)

Rancho BioSciences LLC., San Diego, CA USA.

Ewy A Mathé (EA)

National Center for Advancing Translational Sciences, Rockville, MD, USA.

Matthew D Hall (MD)

National Center for Advancing Translational Sciences, Rockville, MD, USA.

Samuel G Michael (SG)

National Center for Advancing Translational Sciences, Rockville, MD, USA.

Alexander G Godfrey (AG)

National Center for Advancing Translational Sciences, Rockville, MD, USA.

Jordi Mestres (J)

Research Group on Systems Pharmacology, Research Program on Biomedical Informatics (GRIB), IMIM Hospital del Mar Medical Research Institute and University Pompeu Fabra, Barcelona, Catalonia, Spain.

Lars J Jensen (LJ)

Novo Nordisk Foundation Center for Protein Research, Faculty of Health and Medical Sciences, University of Copenhagen, Copenhagen, Denmark.

Tudor I Oprea (TI)

Department of Internal Medicine, University of New Mexico School of Medicine, Albuquerque, NM, USA.
Novo Nordisk Foundation Center for Protein Research, Faculty of Health and Medical Sciences, University of Copenhagen, Copenhagen, Denmark.
UNM Comprehensive Cancer Center, Albuquerque, NM, USA.
Department of Rheumatology and Inflammation Research, Institute of Medicine, Sahlgrenska Academy at University of Gothenburg, Gothenburg, Sweden.

Classifications MeSH