Evidence map›Paper›PMID 41187514›Full record

ArticleDrug metabolism and disposition: the biological fate of chemicals2025

Pharmaceutical Metabolite Data Base, PharmMet DB: Reference data base for drug metabolites generated by human liver S9 fraction.

Jennifer Jeon, Zachery R Jarrell, Choon-Myung Lee, Grant Singer, Jaclyn Weinberg, Ken H Liu, Edward T Morgan, Young-Mi Go, Dean P Jones

Abstract read
In one paragraph

Article in Drug metabolism and disposition: the biological fate of chemicals, 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. 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

9 authors.

Jennifer JeonDivision of Pulmonary, Allergy and Critical Care Medicine, Emory University, Atlanta, Georgia; Graduate Division of Biological and Biomedical Sciences, Molecular and Systems Pharmacology, Emory University, Atlanta, Georgia.
Zachery R JarrellDivision of Pulmonary, Allergy and Critical Care Medicine, Emory University, Atlanta, Georgia.
Choon-Myung LeeDivision of Pulmonary, Allergy and Critical Care Medicine, Emory University, Atlanta, Georgia.
Grant SingerDivision of Pulmonary, Allergy and Critical Care Medicine, Emory University, Atlanta, Georgia; Graduate Division of Biological and Biomedical Sciences, Molecular and Systems Pharmacology, Emory University, Atlanta, Georgia.
Jaclyn WeinbergDivision of Pulmonary, Allergy and Critical Care Medicine, Emory University, Atlanta, Georgia; Graduate Division of Biological and Biomedical Sciences, Molecular and Systems Pharmacology, Emory University, Atlanta, Georgia.
Ken H LiuDivision of Pulmonary, Allergy and Critical Care Medicine, Emory University, Atlanta, Georgia.
Edward T MorganDepartment of Pharmacology and Chemical Biology, Emory University School of Medicine, Atlanta, Georgia.
Young-Mi GoDivision of Pulmonary, Allergy and Critical Care Medicine, Emory University, Atlanta, Georgia.
Dean P JonesDivision of Pulmonary, Allergy and Critical Care Medicine, Emory University, Atlanta, Georgia. Electronic address: dpjones@emory.edu.

Funding

Pilot Project ProgramP30ES019776 · NIEHS · EMORY UNIVERSITY · PI William Michael Caudle · 2013 to 2026
$22.6M
Early mid-life environmental toxicant exposures and AD/ADRD risk in CARDIAU01AG088658 · NIA · UNIVERSITY OF PENNSYLVANIA · PI Aimin Chen, Lifang Hou · 2024 to 2026
$6.5M
Environmental Exposome as a Driver of Race/Ethnicity Differences in Alzheimer's DiseaseR01AG085279 · NIA · UT SOUTHWESTERN MEDICAL CENTER · PI DWIGHT C. German, Dean Paul Jones · 2024 to 2026
$3.2M
Cadmium-potentiated metabolic reprogramming in pathogenesis of lung fibrosisR01ES031980 · NIEHS · EMORY UNIVERSITY · PI GO KANG, YOUNG-MI · 2021 to 2025
$2.2M
Discriminatory Mechanisms in Early-Onset and Lethal Prostate CancerR01CA264519 · NCI · PUBLIC HEALTH INSTITUTE · PI COHN, BARBARA A, JONES, DEAN PAUL · 2021 to 2025
$1.9M
Association of the in Utero Exposome with Life-Course Cognition and Prodromal Alzheimer's Disease in Midlife.R01NS130713 · NINDS · PUBLIC HEALTH INSTITUTE · PI BARBARA A COHN, Dean Paul Jones · 2025 to 2026
$1.4M
Microbiome Metabolite Valerobetaine: Mechanisms in AgingR21AG080247 · NIA · EMORY UNIVERSITY · PI GO KANG, YOUNG-MI, JONES, DEAN PAUL · 2023 to 2023
$430k
NCI NIH HHS R01 CA264519NIA NIH HHS R01 AG085279NIA NIH HHS R21 AG080247NIA NIH HHS U01 AG088658NIEHS NIH HHS P30 ES019776NIEHS NIH HHS R01 ES031980NINDS NIH HHS R01 NS130713
6 · The paper itself

Abstract

Drug monitoring is an essential component of precision therapeutics, yet existing data bases to support therapeutic monitoring are limited to data curated from the scientific literature or predicted in silico. We used human liver S9 fraction to generate metabolites from 1114 therapeutic drugs spanning diverse drug classes. Metabolites were analyzed by liquid chromatography-high-resolution mass spectrometry, annotated through differential analysis of preincubation and postincubation samples, curated by comparison to predicted metabolites from BioTransformer 3.0, and compiled into a human liver pharmaceutical metabolite resource, named "Pharmaceutical Metabolite Data Base (PharmMet DB)." Liquid chromatography-high-resolution mass spectrometry showed heterogeneity in product generation, with some drugs mostly being converted to predicted metabolites, while others were converted to hundreds of unpredicted products characterized by mass-to-charge ratio and chromatographic retention time. Phase I metabolism was dominant, with 30,752 oxidized drug metabolites. Glucuronidation was dominant for phase II metabolism, with 6311 drug metabolites. Notably, 89% of tested drugs produced at least 1 metabolite that was not predicted on BioTransformer 3.0, and these novel metabolites were most frequently detected for anti-inflammatory, central nervous system and antimicrobial drug classes. PharmMet DB provides experimental metabolite profiles to detect therapeutic drug exposures in human biospecimens without a requirement for prescription history. PharmMet DB usage with human epidemiology will advance pharmacometabolomics to improve understanding of drug efficacy, adverse reactions, and interactions in precision medicine. SIGNIFICANCE STATEMENT: Pharmaceutical Metabolite Data Base is a new data base of therapeutic drug metabolites suitable for use with liquid chromatography-high-resolution mass spectrometry to monitor patient adherence, detect unreported drug use, for example, in clinical trials, and enhance pharmacoexposomics and pharmacogenomics research. The data base was generated by incubation of therapeutic agents with human liver S9 fraction and curated relative to in silico predicted metabolites. Associated metadata for metabolic processes and drug classes enhance utility for clinical use, especially with untargeted metabolomics analyses of human samples.

Indexed as

Databases, PharmaceuticalLiverBiotransformationChromatography, LiquidDatabases, FactualDrug MonitoringHumansMass SpectrometryMicrosomes, LiverPharmaceutical PreparationsPharmaceutical PreparationsDrug acetylationDrug glutathionylationDrug metabolismDrug oxidationDrug sulfationPharmMet DB

Identifiers

PMID41187514
PMCPMC12923290

What OpenQuestion holds

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LicenceCC BY-NC-ND
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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.