Title:
MASS SPECTROMETRY METHOD AND SYSTEM
Document Type and Number:
WIPO Patent Application WO/2023/150900
Kind Code:
A1
Abstract:
In a mass spectrometry method, a deuterium-resolved mass spectrum of a gas sample comprising volatile metabolites that have been excreted from a human or animal subject (50) after ingestion of deuterated water is determined. The deuterium-resolved mass spectrum to determine a presence or amount of at least one deuterated metabolite. Also disclosed is a corresponding mass spectrometry system.
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Inventors:
MARTINEZ-LOZANO SINUES PABLO (CH)
SINGH KAPIL DEV (CH)
ARNOLD KIM (CH)
LI XUE (CN)
CHEN XING (CN)
SINGH KAPIL DEV (CH)
ARNOLD KIM (CH)
LI XUE (CN)
CHEN XING (CN)
Application Number:
PCT/CN2022/075436
Publication Date:
August 17, 2023
Filing Date:
February 08, 2022
Export Citation:
Assignee:
UNIV KINDERSPITAL BEIDER BASEL (CH)
UNIV JINAN (CN)
UNIV JINAN (CN)
International Classes:
A61B5/08; A61B5/00; B01D59/44; G01N33/497; H01J49/26
Domestic Patent References:
| WO2022013413A1 | 2022-01-20 |
Foreign References:
| US20200103396A1 | 2020-04-02 | |||
| CN110200661B | 2021-08-24 | |||
| RU2436506C1 | 2011-12-20 | |||
| EP3559675A1 | 2019-10-30 | |||
| US20100255598A1 | 2010-10-07 |
Other References:
FU, X.R. ET AL.: "Measurement of lipogenic flux by deuterium resolved mass spectrometry", NATURE COMMUNICATIONS, vol. 12, no. 1, 2021, pages 3756
L. SHI ET AL.: "Optical imaging of metabolic dynamics in animals", NATURE COMMUNICATIONS, vol. 9, no. 1, 2008, pages 2995
S. DAVIES ET AL.: "Rapid measurement of deuterium content of breath following oral ingestion to determine body water", PHYSIOL. MEAS., vol. 22, no. 4, November 2001 (2001-11-01), pages 651 - 9, XP020073567, DOI: 10.1088/0967-3334/22/4/301
P. SPANEL ET AL.: "Coordinated FA-MS and SIFT-MS analyses of breath following ingestion of D 0 and ethanol: total body water, dispersal kinetics and ethanol metabolism", PHYSIOL. MEAS., vol. 26, no. 4, August 2005 (2005-08-01), pages 447 - 57, XP020092200, DOI: 10.1088/0967-3334/26/4/011
C. CHAN ET AL.: "A non-invasive, on-line deuterium dilution technique for the measurement of total body water in haemodialysis patients", NEPHROL. DIAL. TRANSPLANT., vol. 23, no. 6, June 2008 (2008-06-01), pages 2064 - 70
D. SMITH ET AL.: "Comparative measurements of total body water in healthy volunteers by online breath deuterium measurement and other near-subject methods", AM. J. CLIN. NUTR., vol. 76, no. 6, December 2002 (2002-12-01), pages 1295 - 301
SCHOENHEIMER, R.D. RITTENBERG: "Deuterium as an Indicator in the Study of Intermediary Metabolism", SCIENCE, vol. 82, no. 2120, 1935, pages 156 - 7
MIYAGI, M.T. KASUMOV: "Monitoring the synthesis of biomolecules using mass spectrometry", PHILOS TRANS A MATH PHYS ENG SCI, vol. 374, no. 2079, 2016
VADAS, O. ET AL.: "Using Hydrogen-Deuterium Exchange Mass Spectrometry to Examine Protein-Membrane Interactions", METHODS ENZYMOL, vol. 583, 2017, pages 143 - 172
LEE, W.N. ET AL.: "In vivo measurement of fatty acids and cholesterol synthesis using D20 and mass isotopomer analysis", AM J PHYSIOL, vol. 266, 1994, pages E699 - 708
ZHANG, Z.R.W. VACHET: "Kinetics of Protein Complex Dissociation Studied by Hydrogen/Deuterium Exchange and Mass Spectrometry", ANAL CHEM, vol. 87, no. 23, 2015, pages 11777 - 83
MILLER, B.F. ET AL.: "CORP: The use of deuterated water for the measurement of protein synthesis", J APPL PHYSIOL, vol. 128, no. 5, 1985, pages 1163 - 1176
ENGEN, J.R.: "Developments in Hydrogen/Deuterium Exchange Mass Spectrometry", ANAL CHEM, vol. 93, no. 1, 2021, pages 567 - 582
SHI, L. ET AL.: "Optical imaging of metabolic dynamics in animals", NAT COMMUN, vol. 9, no. 1, 2018, pages 2995, XP055630189, DOI: 10.1038/s41467-018-05401-3
TEJERO RIOSERAS, A.: "Comprehensive Real-Time Analysis of the Yeast Volatilome", SCI REP, vol. 7, no. 1, 2017, pages 14236
SINGH, K.D. ET AL.: "Personalised therapeutic management of epileptic patients guided by pathway-driven breath metabolomics", COMMUNICATIONS MEDICINE, vol. 1, no. 1, 2021, pages 21
SHIRASU, M.K. TOUHARA: "The scent of disease: volatile organic compounds of the human body related to disease and disorder", J BIOCHEM, vol. 150, no. 3, 2011, pages 257 - 66, XP055219359, DOI: 10.1093/jb/mvr090
YIN, Z. ET AL.: "In vivo monitoring of volatile metabolic trajectories enables rapid diagnosis of influenza A infection", CHEM COMMUN (CAMB, vol. 57, no. 39, 2021, pages 4791 - 4794
CHEN, X. ET AL.: "Online Real-Time Monitoring of Exhaled Breath Particles Reveals Unnoticed Transport of Nonvolatile Drugs from Blood to Breath", ANALYTICAL, vol. 93, no. 12, 2021, pages 5005 - 5008
SINUES, P.M.L. ET AL.: "Gauging circadian variation in ketamine metabolism by real-time breath analysis", CHEMICAL COMMUNICATIONS, vol. 53, no. 14, 2017, pages 2264 - 2267
LI, X.: " Drug Pharmacokinetics Determined by Real-Time Analysis of Mouse Breath", ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, vol. 54, no. 27, 2015, pages 7815 - 7818
KESSNER, D. ET AL.: "ProteoWizard: open source software for rapid proteomics tools development", BIOINFORMATICS, vol. 24, no. 21, 2008, pages 2534 - 6
KIND, T.O. FIEHN: "Seven Golden Rules for heuristic filtering of molecular formulas obtained by accurate mass spectrometry", BMC BIOINFORMATICS, vol. 8, 2007, pages 105, XP021021747, DOI: 10.1186/1471-2105-8-105
CHONG, J.J. XIA: "MetaboAnalystR: an R package for flexible and reproducible analysis of metabolomics data", BIOINFORMATICS, vol. 34, no. 24, 2018, pages 4313 - 4314
MARTINEZ-LOZANO, P.J. FERNANDEZ DE LA MORA: "On-line Detection of Human Skin Vapors", JOURNAL OF THE AMERICAN SOCIETY FOR MASS SPECTROMETRY, vol. 20, no. 6, 2009, pages 1060 - 1063, XP026494906, DOI: 10.1016/j.jasms.2009.01.012
MARTINEZ-LOZANO, P.J. FERNANDEZ DE LA MORA: "Direct analysis of fatty acid vapors in breath by electrospray ionization and atmospheric pressure ionization-mass spectrometry", ANALYTICAL CHEMISTRY, vol. 80, no. 21, 2008, pages 8210 - 8215, XP055497434, DOI: 10.1021/ac801185e
MARTINEZ-LOZANO, P. ET AL.: "Secondary Electrospray Ionization (SESI) of Ambient Vapors for Explosive Detection at Concentrations Below Parts Per Trillion", JOURNAL OF THE AMERICAN SOCIETY FOR MASS SPECTROMETRY, vol. 20, no. 2, 2009, pages 287 - 294, XP025917800, DOI: 10.1016/j.jasms.2008.10.006
GARCFA-GOMEZ, D. ET AL.: "Real-Time Quantification of Amino Acids in the Exhalome by Secondary Electrospray Ionization-Mass Spectrometry: A Proof-of-Principle Study", CLINICAL CHEMISTRY, vol. 62, no. 9, 2016, pages 1230 - 7
ADAM, M.E.: " Mass-Spectrometry Analysis of Mixed-Breath, Isolated-Bronchial-Breath, and Gastric-Endoluminal-Air Volatile Fatty Acids in Esophagogastric Cancer", ANAL CHEM, vol. 91, no. 5, 2019, pages 3740 - 3746, XP055687484, DOI: 10.1021/acs.analchem.9b00148
KOSTYUKEVICH, Y.: "Hydrogen/deuterium exchange in mass spectrometry", MASS SPECTROM REV, vol. 37, no. 6, 2018, pages 811 - 853
GROCHOLSKA, P., R. BACHOR: "Trends in the Hydrogen-Deuterium Exchange at the Carbon Centers. Preparation of Internal Standards for Quantitative Analysis by LC-MS", MOLECULES, vol. 26, no. 10, 2021
ENGLANDER, S.W. ET AL.: "Mechanisms and uses of hydrogen exchange", CURR OPIN STRUCT BIOL, vol. 6, no. 1, 1996, pages 18 - 23
BENDER, D.A.: "Encyclopedia of Food Sciences and Nutrition", 2003, ACADEMIC, article "GLUCOSE / Function and Metabolism", pages: 2904 - 2911
PESSIONE, E.: "Lactic acid bacteria contribution to gut microbiota complexity: lights and shadows", FRONT CELL INFECT MICROBIOL, vol. 2, 2012, pages 86
DALILE, B. ET AL.: "The role of short-chain fatty acids in microbiota-gut-brain communication", NAT REV GASTROENTEROL HEPATOL, vol. 16, no. 8, 2019, pages 461 - 478, XP036844618, DOI: 10.1038/s41575-019-0157-3
L. SHI ET AL.: "Optical imaging of metabolic dynamics in animals", NATURE COMMUNICATIONS, vol. 9, no. 1, 2008, pages 2995
S. DAVIES ET AL.: "Rapid measurement of deuterium content of breath following oral ingestion to determine body water", PHYSIOL. MEAS., vol. 22, no. 4, November 2001 (2001-11-01), pages 651 - 9, XP020073567, DOI: 10.1088/0967-3334/22/4/301
P. SPANEL ET AL.: "Coordinated FA-MS and SIFT-MS analyses of breath following ingestion of D 0 and ethanol: total body water, dispersal kinetics and ethanol metabolism", PHYSIOL. MEAS., vol. 26, no. 4, August 2005 (2005-08-01), pages 447 - 57, XP020092200, DOI: 10.1088/0967-3334/26/4/011
C. CHAN ET AL.: "A non-invasive, on-line deuterium dilution technique for the measurement of total body water in haemodialysis patients", NEPHROL. DIAL. TRANSPLANT., vol. 23, no. 6, June 2008 (2008-06-01), pages 2064 - 70
D. SMITH ET AL.: "Comparative measurements of total body water in healthy volunteers by online breath deuterium measurement and other near-subject methods", AM. J. CLIN. NUTR., vol. 76, no. 6, December 2002 (2002-12-01), pages 1295 - 301
SCHOENHEIMER, R.D. RITTENBERG: "Deuterium as an Indicator in the Study of Intermediary Metabolism", SCIENCE, vol. 82, no. 2120, 1935, pages 156 - 7
MIYAGI, M.T. KASUMOV: "Monitoring the synthesis of biomolecules using mass spectrometry", PHILOS TRANS A MATH PHYS ENG SCI, vol. 374, no. 2079, 2016
VADAS, O. ET AL.: "Using Hydrogen-Deuterium Exchange Mass Spectrometry to Examine Protein-Membrane Interactions", METHODS ENZYMOL, vol. 583, 2017, pages 143 - 172
LEE, W.N. ET AL.: "In vivo measurement of fatty acids and cholesterol synthesis using D20 and mass isotopomer analysis", AM J PHYSIOL, vol. 266, 1994, pages E699 - 708
ZHANG, Z.R.W. VACHET: "Kinetics of Protein Complex Dissociation Studied by Hydrogen/Deuterium Exchange and Mass Spectrometry", ANAL CHEM, vol. 87, no. 23, 2015, pages 11777 - 83
MILLER, B.F. ET AL.: "CORP: The use of deuterated water for the measurement of protein synthesis", J APPL PHYSIOL, vol. 128, no. 5, 1985, pages 1163 - 1176
ENGEN, J.R.: "Developments in Hydrogen/Deuterium Exchange Mass Spectrometry", ANAL CHEM, vol. 93, no. 1, 2021, pages 567 - 582
SHI, L. ET AL.: "Optical imaging of metabolic dynamics in animals", NAT COMMUN, vol. 9, no. 1, 2018, pages 2995, XP055630189, DOI: 10.1038/s41467-018-05401-3
TEJERO RIOSERAS, A.: "Comprehensive Real-Time Analysis of the Yeast Volatilome", SCI REP, vol. 7, no. 1, 2017, pages 14236
SINGH, K.D. ET AL.: "Personalised therapeutic management of epileptic patients guided by pathway-driven breath metabolomics", COMMUNICATIONS MEDICINE, vol. 1, no. 1, 2021, pages 21
SHIRASU, M.K. TOUHARA: "The scent of disease: volatile organic compounds of the human body related to disease and disorder", J BIOCHEM, vol. 150, no. 3, 2011, pages 257 - 66, XP055219359, DOI: 10.1093/jb/mvr090
YIN, Z. ET AL.: "In vivo monitoring of volatile metabolic trajectories enables rapid diagnosis of influenza A infection", CHEM COMMUN (CAMB, vol. 57, no. 39, 2021, pages 4791 - 4794
CHEN, X. ET AL.: "Online Real-Time Monitoring of Exhaled Breath Particles Reveals Unnoticed Transport of Nonvolatile Drugs from Blood to Breath", ANALYTICAL, vol. 93, no. 12, 2021, pages 5005 - 5008
SINUES, P.M.L. ET AL.: "Gauging circadian variation in ketamine metabolism by real-time breath analysis", CHEMICAL COMMUNICATIONS, vol. 53, no. 14, 2017, pages 2264 - 2267
LI, X.: " Drug Pharmacokinetics Determined by Real-Time Analysis of Mouse Breath", ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, vol. 54, no. 27, 2015, pages 7815 - 7818
KESSNER, D. ET AL.: "ProteoWizard: open source software for rapid proteomics tools development", BIOINFORMATICS, vol. 24, no. 21, 2008, pages 2534 - 6
KIND, T.O. FIEHN: "Seven Golden Rules for heuristic filtering of molecular formulas obtained by accurate mass spectrometry", BMC BIOINFORMATICS, vol. 8, 2007, pages 105, XP021021747, DOI: 10.1186/1471-2105-8-105
CHONG, J.J. XIA: "MetaboAnalystR: an R package for flexible and reproducible analysis of metabolomics data", BIOINFORMATICS, vol. 34, no. 24, 2018, pages 4313 - 4314
MARTINEZ-LOZANO, P.J. FERNANDEZ DE LA MORA: "On-line Detection of Human Skin Vapors", JOURNAL OF THE AMERICAN SOCIETY FOR MASS SPECTROMETRY, vol. 20, no. 6, 2009, pages 1060 - 1063, XP026494906, DOI: 10.1016/j.jasms.2009.01.012
MARTINEZ-LOZANO, P.J. FERNANDEZ DE LA MORA: "Direct analysis of fatty acid vapors in breath by electrospray ionization and atmospheric pressure ionization-mass spectrometry", ANALYTICAL CHEMISTRY, vol. 80, no. 21, 2008, pages 8210 - 8215, XP055497434, DOI: 10.1021/ac801185e
MARTINEZ-LOZANO, P. ET AL.: "Secondary Electrospray Ionization (SESI) of Ambient Vapors for Explosive Detection at Concentrations Below Parts Per Trillion", JOURNAL OF THE AMERICAN SOCIETY FOR MASS SPECTROMETRY, vol. 20, no. 2, 2009, pages 287 - 294, XP025917800, DOI: 10.1016/j.jasms.2008.10.006
GARCFA-GOMEZ, D. ET AL.: "Real-Time Quantification of Amino Acids in the Exhalome by Secondary Electrospray Ionization-Mass Spectrometry: A Proof-of-Principle Study", CLINICAL CHEMISTRY, vol. 62, no. 9, 2016, pages 1230 - 7
ADAM, M.E.: " Mass-Spectrometry Analysis of Mixed-Breath, Isolated-Bronchial-Breath, and Gastric-Endoluminal-Air Volatile Fatty Acids in Esophagogastric Cancer", ANAL CHEM, vol. 91, no. 5, 2019, pages 3740 - 3746, XP055687484, DOI: 10.1021/acs.analchem.9b00148
KOSTYUKEVICH, Y.: "Hydrogen/deuterium exchange in mass spectrometry", MASS SPECTROM REV, vol. 37, no. 6, 2018, pages 811 - 853
GROCHOLSKA, P., R. BACHOR: "Trends in the Hydrogen-Deuterium Exchange at the Carbon Centers. Preparation of Internal Standards for Quantitative Analysis by LC-MS", MOLECULES, vol. 26, no. 10, 2021
ENGLANDER, S.W. ET AL.: "Mechanisms and uses of hydrogen exchange", CURR OPIN STRUCT BIOL, vol. 6, no. 1, 1996, pages 18 - 23
BENDER, D.A.: "Encyclopedia of Food Sciences and Nutrition", 2003, ACADEMIC, article "GLUCOSE / Function and Metabolism", pages: 2904 - 2911
PESSIONE, E.: "Lactic acid bacteria contribution to gut microbiota complexity: lights and shadows", FRONT CELL INFECT MICROBIOL, vol. 2, 2012, pages 86
DALILE, B. ET AL.: "The role of short-chain fatty acids in microbiota-gut-brain communication", NAT REV GASTROENTEROL HEPATOL, vol. 16, no. 8, 2019, pages 461 - 478, XP036844618, DOI: 10.1038/s41575-019-0157-3
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