Evidence map›Paper›PMID 39282570›Full record

ArticleBioMed research international2024

Exploring Lead-Like Molecules of Traditional Chinese Medicine for Treatment Quest against

Zarrin Basharat, Ibrar Ahmed, Sulaiman Mohammed Alnasser, Alotaibi Meshal, Yasir Waheed

Abstract read
In one paragraph

Article in BioMed research international, 2024. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Not yet cited in PubMed.

0numbers the graph read from it
0cells of the map it votes in
0citing 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

0 citing papers in PubMed.

No citing paper in PubMed yet.

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

5 authors.

Zarrin BasharatAlpha Genomics (Private) Limited, Islamabad 45710, Pakistan.ORCID https://orcid.org/0000-0003-1785-3803
Ibrar AhmedAlpha Genomics (Private) Limited, Islamabad 45710, Pakistan.ORCID https://orcid.org/0000-0002-8744-9622
Sulaiman Mohammed AlnasserDepartment of Pharmacology and Toxicology, Unaizah College of Pharmacy, Qassim University, Buraydah 52571, Saudi Arabia.ORCID https://orcid.org/0000-0001-8678-5029
Alotaibi MeshalDepartment of Pharmacy Practice, College of Pharmacy, University of Hafr Al Batin, Hafar Al Batin, Saudi Arabia.ORCID https://orcid.org/0000-0002-9823-3333
Yasir WaheedOffice of Research, Innovation and Commercialization (ORIC), Shaheed Zulfiqar Ali Bhutto Medical University (SZABMU), Islamabad 44000, Pakistan.ORCID https://orcid.org/0000-0002-5789-4215

Funding

No grant is acknowledged in the PubMed record.

6 · The paper itself

Abstract

Background: Results: Among the screened compounds, ZINC70454134 displayed the most favorable characteristics in terms of binding, stability, absorption, and safety parameters. Overall, traditional Chinese medicine (TCM) compounds exhibited high bioavailability, but in diseased states (cirrhosis, renal impairment, and steatosis), there was a significant decrease in absorption, Cmax, and AUC of the compounds compared to the healthy state. Furthermore, MD simulation demonstrated that the ODCase-ZINC70454134 complex had a superior overall binding affinity, supported by PCA proportion of variance and eigenvalue rank analysis. These favorable characteristics underscore its potential as a promising drug candidate. Conclusion: The computer-aided drug design approach employed for this study helped expedite the discovery of antibacterial compounds against

Indexed as

Medicine, Chinese TraditionalMolecular Docking SimulationAnti-Bacterial AgentsComputer SimulationDrugs, Chinese HerbalHumansMolecular Dynamics SimulationAnti-Bacterial AgentsDrugs, Chinese Herbal

Identifiers

PMID39282570
PMCPMC11401669

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Registered trials

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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 OpenQuestion graph.