» Articles » PMID: 38864383

Colloidal Aggregation Confounds Cell-Based Covid-19 Antiviral Screens

Overview
Journal J Med Chem
Specialty Chemistry
Date 2024 Jun 12
PMID 38864383
Authors
Affiliations
Soon will be listed here.
Abstract

Colloidal aggregation is one of the largest contributors to false positives in early drug discovery. Here, we consider aggregation's role in cell-based infectivity assays in Covid-19 drug repurposing. We investigated the potential aggregation of 41 drug candidates reported as SARs-CoV-2 entry inhibitors. Of these, 17 formed colloidal particles by dynamic light scattering and exhibited detergent-dependent enzyme inhibition. To evaluate the impact of aggregation on antiviral efficacy in cells, we presaturated the colloidal drug suspensions with BSA or spun them down by centrifugation and measured the effects on spike pseudovirus infectivity. Antiviral potencies diminished by at least 10-fold following both BSA and centrifugation treatments, supporting a colloid-based mechanism. Aggregates induced puncta of the labeled spike protein in fluorescence microscopy, consistent with sequestration of the protein on the colloidal particles. These observations suggest that colloidal aggregation is common among cell-based antiviral drug repurposing and offers rapid counter-screens to detect and eliminate these artifacts.

Citing Articles

Structure Activity of β-Amidomethyl Vinyl Sulfones as Covalent Inhibitors of nsP2 Cysteine Protease with Antialphavirus Activity.

Ghoshal A, Asressu K, Hossain M, Brown P, Nandakumar M, Vala A J Med Chem. 2024; 67(18):16505-16532.

PMID: 39235978 PMC: 11440497. DOI: 10.1021/acs.jmedchem.4c01346.


Structure Activity of β-Amidomethyl Vinyl Sulfones as Covalent Inhibitors of nsP2 Cysteine Protease with Anti-alphavirus Activity.

Ghoshal A, Asressu K, Hossain M, Brown P, Merten E, Sears J bioRxiv. 2024; .

PMID: 38915519 PMC: 11195264. DOI: 10.1101/2024.06.12.598722.

References
1.
Ku K, Shin H, Kim H, Kim B, Kim S, Kim C . Repurposing Screens of FDA-Approved Drugs Identify 29 Inhibitors of SARS-CoV-2. J Microbiol Biotechnol. 2020; 30(12):1843-1853. PMC: 9728307. DOI: 10.4014/jmb.2009.09009. View

2.
van Breemen R, Muchiri R, Bates T, Weinstein J, Leier H, Farley S . Cannabinoids Block Cellular Entry of SARS-CoV-2 and the Emerging Variants. J Nat Prod. 2022; 85(1):176-184. PMC: 8768006. DOI: 10.1021/acs.jnatprod.1c00946. View

3.
Papapetropoulos A, Szabo C . Inventing new therapies without reinventing the wheel: the power of drug repurposing. Br J Pharmacol. 2018; 175(2):165-167. PMC: 5758397. DOI: 10.1111/bph.14081. View

4.
McGovern S, Caselli E, Grigorieff N, Shoichet B . A common mechanism underlying promiscuous inhibitors from virtual and high-throughput screening. J Med Chem. 2002; 45(8):1712-22. DOI: 10.1021/jm010533y. View

5.
Pushpakom S, Iorio F, Eyers P, Jane Escott K, Hopper S, Wells A . Drug repurposing: progress, challenges and recommendations. Nat Rev Drug Discov. 2018; 18(1):41-58. DOI: 10.1038/nrd.2018.168. View