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[Preprint]. 2020 Apr 30:rs.3.rs-25643. [Version 1] doi: 10.21203/rs.3.rs-25643/v1

Table 1. Drug target groupings.

Drug targets with iLINCS signatures that are in use or under investigation for the treatment of COVID-19 were grouped together if they met a least two of the three following criteria: Canonical Mechanism of Action, referenced from the database DrugBank (https://www.drugbank.ca/); Anatomic Therapeutic Chemical classification, referenced from https://www.whocc.no/atc ddd index/: structural similarity as determined by intracluster Tanimoto coefficient. F = Febratininb; R = Ruxolinitib; B = Bariticinib

Drug Cluster Drug Canonical Mechanism of Action Anatomical Therapeutic Chemical
First Level
Tanimoto Coefficient
1 Chloroquine
Hydroxychloroquine
Toll-like receptor antagonists Antiparasitic Products, Insecticides and Repellants 0.84
2 Lopinavir
Ritonavir
Protease inhibitors Anti-infective for Systemic Use 0.72
3 Fedratinib
Ruxolinitib
Bariticinib
JAK inhibitors Antineoplastic and Immunomodulating
Agents
F − R: 0.25
F − B: 0.20
B − R: 0.72
4 Azithromycin Macrolide antibiotic Anti-Infective for Systemic Use 1
5 Losartan Angiotensin receptor blocker antagonist Cardiovascular System 1