Relationship between Volatile Organic Compounds (VOCs) in exhaled breath determined by Proton Transfer Reaction Time of Flight Mass Spectrometry (PTR-TOF-MS), clinical characteristics and airway inflammation in COPD

Relationship between Volatile Organic Compounds (VOCs) in exhaled breath determined by Proton Transfer Reaction Time of Flight Mass Spectrometry (PTR-TOF-MS), clinical characteristics and airway inflammation in COPD

Carr1, L. Bryant2, A. Yousuf1, R. Cordell2, M. Wilde2, S. Siddiqui1, P. Monks2, C. Brightling1

1Department of Infection, Immunity and Inflammation, University of Leicester, Leicester, UK,2Department of Chemistry, University of Leicester, Leicester, UK 

 

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Abstract:

Background: Chronic obstructive pulmonary disease (COPD) is a heterogeneous condition. Breathomics presents an opportunity to phenotype this heterogeneity but how breath volatile organic compounds (VOCs) relate to clinical features, airway physiology and inflammation is uncertain.  Methods: We undertook a single centre prospective study in subjects with moderate to severe COPD. We assessed 379 breath samples obtained at stable visits. The breath VOCs were examined using Proton Transfer Reaction-Time Flight-Mass Spectrometry (PTR-TOF-MS). Principal component analysis (PCA) and partial least squares discriminant analysis (PLS-DA) models were undertaken to determine whether there were distinct VOC profiles associated with spirometry, plethysmography lung volumes, gas transfer, symptoms (mMRC and CAT questionnaires), sputum eosinophils (< versus ≥1%) and neutrophils (< versus ≥61%).  Results: 34 COPD subjects were studied of which 8 were women. The subjects had a mean age 70 (66-74) years and FEV1 52% predicted (32.2-72.3%). There were no distinct VOC breath profiles that were associated with airway physiology or symptoms. The sputum eosinophil and sputum neutrophil cut-offs did identify distinct profiles with a receiver operator characteristic (ROC) curve area-under-the-curve (95% confidence intervals) 0.84 (0.77-0.86) and 0.80 (0.69-0.81) respectively.  Conclusion: VOC breath profiles are related to airway inflammation but not physiology or symptoms in COPD.

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  • Was the ROC curve generated from training set,cross validation, blind test set? 

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