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Analytical methods

Comparative study #1
Chromatography LC
Ion source ESI
Positive/Negative mode negative
Mass analyzer triple quadrupole
Identification level MS/MS

Sample information

Comparative study #1
Country Poland
Specimen serum
Marker function diagnosis
Participants(Case) Cancer type adenocarcinoma, squamous cell carcinoma
StageI, II, III
Number90
Gender (M,F)58, 32
Mean age (range) (M,F)64 ± 6.9
Smoking statussmoker, non-smoker, unknown
Participants(Control) Type healthy
Number62
Gender (M,F)40, 22
Mean age (range) (M,F)62 ± 8.8
Smoking statussmoker, non-smoker, unknown

Data processing and metabolite identification

Data processing software Analyst software
Database search

Statistical analysis

Differential analysis method Mann-Whitney U test
Classification method ROC curve analysis
Survival analysis method

Lung cancer-related metabolites identified in the paper

Metabolite Author-emphasized biomarkers Mean concentration (case) Mean concentration (control) Fold change (case/control) P-value FDR VIP
glutaric acid V 0.52 ± 0.23 μmol/l 0.52 ± 0.2 μmol/l 1.00 0.84
fumaric acid V 1.29 ± 1.15 μmol/l 1.5 ± 1.22 μmol/l 0.86 3.00e-04
lactic acid V 1.89 ± 0.71 mmol/l 2.2 ± 0.8 mmol/l 0.86 9.79e-03
pyroglutamic acid V 26.99 ± 11.56 μmol/l 35.28 ± 10.22 μmol/l 0.77 2.64e-08
2-hydroxybutyric acid V 72.43 ± 33.38 μmol/l 58.99 ± 33.39 μmol/l 1.23 2.83e-03
succinic acid V 8.52 ± 2.23 μmol/l 8.9 ± 2.04 μmol/l 0.96 0.18
Metabolite Author-emphasized biomarkers Cutoff value AUROC (95%CI) Sensitivity (%) Specificity (%) Accuracy (%)
glutaric acid V 0.515
fumaric acid V 0.673
lactic acid V 0.624
pyroglutamic acid V stage I vs. control: 29.6; stage II vs. control: 29.6; stage III vs. control: 28 0.766; stage I vs. control: 0.752; stage II vs. control: 0.748; stage III vs. control: 0.799 stage I vs. control: 0.8; stage II vs. control: 0.8; stage III vs. control: 0.8 stage I vs. control: 0.7; stage II vs. control: 0.7; stage III vs. control: 0.7
2-hydroxybutyric acid V 0.643
succinic acid V 0.564

Paper graphical summary