Metabolomics in epidemiology: sources of variability in metabolite measurements and implications

Cancer Epidemiol Biomarkers Prev. 2013 Apr;22(4):631-40. doi: 10.1158/1055-9965.EPI-12-1109. Epub 2013 Feb 8.

Abstract

Background: Metabolite levels within an individual vary over time. This within-individual variability, coupled with technical variability, reduces the power for epidemiologic studies to detect associations with disease. Here, the authors assess the variability of a large subset of metabolites and evaluate the implications for epidemiologic studies.

Methods: Using liquid chromatography/mass spectrometry (LC/MS) and gas chromatography-mass spectroscopy (GC/MS) platforms, 385 metabolites were measured in 60 women at baseline and year-one of the Shanghai Physical Activity Study, and observed patterns were confirmed in the Prostate, Lung, Colorectal, and Ovarian Cancer Screening study.

Results: Although the authors found high technical reliability (median intraclass correlation = 0.8), reliability over time within an individual was low. Taken together, variability in the assay and variability within the individual accounted for the majority of variability for 64% of metabolites. Given this, a metabolite would need, on average, a relative risk of 3 (comparing upper and lower quartiles of "usual" levels) or 2 (comparing quartiles of observed levels) to be detected in 38%, 74%, and 97% of studies including 500, 1,000, and 5,000 individuals. Age, gender, and fasting status factors, which are often of less interest in epidemiologic studies, were associated with 30%, 67%, and 34% of metabolites, respectively, but the associations were weak and explained only a small proportion of the total metabolite variability.

Conclusion: Metabolomics will require large, but feasible, sample sizes to detect the moderate effect sizes typical for epidemiologic studies.

Impact: We offer guidelines for determining the sample sizes needed to conduct metabolomic studies in epidemiology.

Publication types

  • Comparative Study
  • Multicenter Study
  • Research Support, N.I.H., Extramural
  • Research Support, N.I.H., Intramural
  • Research Support, Non-U.S. Gov't

MeSH terms

  • Adult
  • Aged
  • Aged, 80 and over
  • Biomarkers, Tumor / analysis*
  • Case-Control Studies
  • Chromatography, Gas
  • Chromatography, Liquid
  • Cohort Studies
  • Epidemiologic Studies
  • Female
  • Humans
  • Male
  • Mass Spectrometry
  • Metabolomics / standards*
  • Middle Aged
  • Neoplasms / diagnosis*
  • Neoplasms / epidemiology*
  • Neoplasms / metabolism
  • Prognosis
  • Reproducibility of Results

Substances

  • Biomarkers, Tumor