Chemical Profiling and Scaffold-Based Drug-Discovery Analysis of Bioactive Compounds from

Deli-Bright N T Oku, Garland Kgosi More, Yannick Nuapia, Ramakwala Christinah Chokwe

Abstract read

In one paragraph

Article in Journal of chemical information and modeling, 2026. 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

4 authors.

Deli-Bright N T OkuDepartment of Chemistry, The Science Campus, College of Science Engineering and Technology, University of South Africa, Corner Christiaan de Wet Road and Pioneer Avenue, Florida Park, Roodepoort1709, South Africa.ORCID 0009-0003-4815-2759

Garland Kgosi MoreCollege of Agriculture and Environmental Sciences, CAES Laboratories, University of South Africa, Private Bag X6, Johannesburg1710, Florida, South Africa.

Yannick NuapiaDepartment of Pharmacy, Turfloop Campus, School of Healthcare Science, University of Limpopo, Polokwane0727, South Africa.

Ramakwala Christinah ChokweDepartment of Chemistry, The Science Campus, College of Science Engineering and Technology, University of South Africa, Corner Christiaan de Wet Road and Pioneer Avenue, Florida Park, Roodepoort1709, South Africa.

Funding

No grant is acknowledged in the PubMed record.

6 · The paper itself

Abstract

The scaffold concept is central in medicinal chemistry and drug design to generate, analyze, and capture the core structural frameworks that define bioactive compounds. Natural products and their underlying molecular scaffolds have long provided many of the biologically active ingredients in modern medicines and continue to inspire new therapeutic agents. However, linking these core structural frameworks to observed biological activity remains a key challenge in natural-product research. Here, this study integrates a computational-experimental approach combining scaffold-based drug analysis, chemical profiling, and computational and biological validation to identify bioactive motifs in

Indexed as

Drug DiscoveryFabaceaeAnti-Infective AgentsAntioxidantsGas Chromatography-Mass SpectrometryHumansMolecular Docking SimulationAnti-Infective AgentsAntioxidants

Identifiers

PMID42206975

DOI10.1021/acs.jcim.6c00748

PMCPMC13292205

What OpenQuestion holds

Textmetadata

LicenceCC BY

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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.