Evidence map›Paper›PMID 39645639›Full record

ArticleMolecular diversity2025

Repurposed drugs as PCSK9-LDLR disruptors for lipid lowering and cardiovascular disease therapeutics.

Shelly Singhal Nee Shelly Aggarwal, Divpreet Kaur, Daman Saluja, Kamna Srivastava

Abstract read
PubMed Publisher
In one paragraph

Article in Molecular diversity, 2025. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 1 paper.

0numbers the graph read from it
0cells of the map it votes in
1citing papers in PubMed
–field-weighted citation impact
1 · What the graph read from it

What it found

Each row is one number read from the abstract, on the scale the paper reported it, with its interval. Left of the dashed line favours the treatment, right favours the comparator. Under each row is the sentence it came from. New to these charts? A ten-minute tutorial.

The abstract states no effect estimate the extractor could read, or names no intervention and outcome on the map, so this paper lights no cell and moves no belief. It is still indexed, cited and linked below.

2 · The registry

The trial behind it

Trials whose registry record cites this paper, or whose number appears in the abstract. A trial that started after this paper was published is citing it as background, not reporting it.

Neither the registry nor the abstract names a trial number. If this is a trial report, that itself is worth knowing.

3 · Its place in the literature

Who cites it

1 citing paper in PubMed.

  1. Identification of a peptide inhibitor disrupting the PCSK9-LDLR interactionJournal of enzyme inhibition and medicinal chemistry · 2026
    Article
4 · The record

Corrections and comments

PubMed lists nothing against this paper. Absence here is not a guarantee, only a check that was made.

5 · Who and what money

Authors and funding

4 authors.

Shelly Singhal Nee Shelly Aggarwal *Dr. B.R. Ambedkar Center for Biomedical Research, University of Delhi, Delhi, India.
Divpreet Kaur *Dr. B.R. Ambedkar Center for Biomedical Research, University of Delhi, Delhi, India.
Daman SalujaDr. B.R. Ambedkar Center for Biomedical Research, University of Delhi, Delhi, India.
Kamna SrivastavaDr. B.R. Ambedkar Center for Biomedical Research, University of Delhi, Delhi, India. kamna605@gmail.com.

Funding

Department of Biotechnology, Ministry of Science and Technology, India BT/PR40153/BTIS/137/8/2021 and BT/PR40195/BTIS/137/58/2023
6 · The paper itself

Abstract

The PCSK9 protein binds to LDL receptors (LDLR), leading to their degradation and reduced expression on cell surfaces. This decreased the clearance of LDL cholesterol from the bloodstream, thereby increasing the risk of coronary artery diseases. Targeting the PCSK9-LDL receptor interaction is crucial for regulating LDL cholesterol levels and preventing cardiovascular disease. This study aims to screen low molecular weight inhibitors to disrupt the PCSK9-LDLR interaction. We employed a comprehensive approach combining high-throughput virtual screening of DrugBank database, followed by molecular docking studies using CDOCKER and flexible docking methods. The top four lead compounds were further validated through molecular dynamics (MD) simulations and binding free energy calculations using MM-PBSA. Finally, the in vitro assay confirmed that Benazepril and Quinapril exhibited the highest potency as PCSK9-LDLR disruptors among the top candidates. These lead compounds have the potential to be repurposed as lipid-lowering agents for the treatment of cardiovascular diseases, offering a promising therapeutic strategy.

Indexed as

Cardiovascular DiseasesDrug RepositioningHypolipidemic AgentsPCSK9 InhibitorsProprotein Convertase 9Receptors, LDLHumansMolecular Docking SimulationMolecular Dynamics SimulationProtein BindingHypolipidemic AgentsPCSK9 InhibitorsPCSK9 protein, humanProprotein Convertase 9Receptors, LDLBenazeprilCoronary artery diseaseDrug repurposingHypercholesterolemiaIn-silico drug designPCSK9-LDLR disruptorsQuinapril

Identifiers

What Socratic holds

Texttitle and abstract
Read underepoch 390

Registered trials

None linked

Read under generation 80e0d062 · epoch 390. Bibliography from PubMed, PubMed Central and OpenAlex; grants from NIH RePORTER; trial links from ClinicalTrials.gov; estimates, votes and beliefs from the Socratic graph.