Metabolomic Profiling of Serum for Large Cohort Oral Squamous Cell
Carcinoma Diagnosis
Abstract
Background: Oral squamous cell carcinoma (OSCC) accounts for 90 % of
oral cancers. If a necessary intervention before tumorigenesis could be
conducted, the current 60% 5-year survival rate would be expected to be
majorly improved. This fact motivates the search for developing a highly
sensitive and specific in vitro diagnostic method to conduct rapid OSCC
screening. Method: Serum samples from 819 volunteers, consisted of 241
healthy contrast (HC) and 578 OSCC patients, were collected, and their
metabolic profiles were acquired using conductive polymer spray
ionization mass spectrometry (CPSI-MS). Univariate analysis was used to
select significantly changed metabolite ions in the OSCC group compared
to the HC group. Identities of these metabolite ions were determined by
MS/MS experiments and reconfirmed at the tissue level by desorption
electrospray ionization mass spectrometry (DESI-MS). The supporting
vector machine (SVM) algorithm was employed as the machine learning
model to implement the automatic prediction of OSCC. Results: Through
statistical analysis, 65 metabolites were selected as potential
characteristic marker candidates for serum OSCC screening. In situ
validation by DESI-MSI revealed that 8 out of top 10 metabolites showed
the same trends of change in tissue and serum. With the aid of machine
learning, OSCC can be distinguished from HC with an accuracy of 98.0 %
by cross-validation in the discovery cohort and 89.2% accuracy in the
validation cohort. Furthermore, orthogonal partial least
square-discriminant analysis (OPLS-DA) also showed the potential for
recognizing OSCC stages. Conclusion: Using CPSI-MS combined with SVM, it
is possible to distinguish OSCC from HC in a few minutes with high
specificity and sensitivity, making this rapid diagnostic procedure a
promising approach for high-risk population screening.