TY - JOUR T1 - The NORMAN Suspect List Exchange (NORMAN-SLE): facilitating European and worldwide collaboration on suspect screening in high resolution mass spectrometry A1 - Mohammed Taha,Hiba A1 - Aalizadeh,Reza A1 - Alygizakis,Nikiforos A1 - Antignac,Jean-Philippe A1 - Arp,Hans Peter H. A1 - Bade,Richard A1 - Baker,Nancy A1 - Belova,Lidia A1 - Bijlsma,Lubertus A1 - Bolton,Evan E. A1 - Brack,Werner A1 - Celma,Alberto A1 - Chen,Wen-Ling A1 - Cheng,Tiejun A1 - Chirsir,Parviel A1 - Čirka,Ľuboš A1 - D’agostino,Lisa A. A1 - Djoumbou Feunang,Yannick A1 - Dulio,Valeria A1 - Fischer,Stellan A1 - Gago-Ferrero,Pablo A1 - Galani,Aikaterini A1 - Geueke,Birgit A1 - Głowacka,Natalia A1 - Glüge,Juliane A1 - Groh,Ksenia A1 - Grosse,Sylvia A1 - Haglund,Peter A1 - Hakkinen,Pertti J. A1 - Hale,Sarah E. A1 - Hernandez,Felix A1 - Janssen,Elisabeth M.-L. A1 - Jonkers,Tim A1 - Kiefer,Karin A1 - Kirchner,Michal A1 - Koschorreck,Jan A1 - Krauss,Martin A1 - Krier,Jessy A1 - Lamoree,Marja H. A1 - Letzel,Marion A1 - Letzel,Thomas A1 - Li,Qingliang A1 - Little,James A1 - Liu,Yanna A1 - Lunderberg,David M. A1 - Martin,Jonathan W. A1 - McEachran,Andrew D. A1 - McLean,John A. A1 - Meier,Christiane A1 - Meijer,Jeroen A1 - Menger,Frank A1 - Merino,Carla A1 - Muncke,Jane A1 - Muschket,Matthias A1 - Neumann,Michael A1 - Neveu,Vanessa A1 - Ng,Kelsey A1 - Oberacher,Herbert A1 - O’brien,Jake A1 - Oswald,Peter A1 - Oswaldova,Martina A1 - Picache,Jaqueline A. A1 - Postigo,Cristina A1 - Ramirez,Noelia A1 - Reemtsma,Thorsten A1 - Renaud,Justin A1 - Rostkowski,Pawel A1 - Rüdel,Heinz A1 - Salek,Reza M. A1 - Samanipour,Saer A1 - Scheringer,Martin A1 - Schliebner,Ivo A1 - Schulz,Wolfgang A1 - Schulze,Tobias A1 - Sengl,Manfred A1 - Shoemaker,Benjamin A. A1 - Sims,Kerry A1 - Singer,Heinz A1 - Singh,Randolph A1 - Sumarah,Mark A1 - Thiessen,Paul A. A1 - Thomas,Kevin V. A1 - Torres,Sonia A1 - Trier,Xenia A1 - Van Wezel,Annemarie P. A1 - Vermeulen,Roel C. H. A1 - Vlaanderen,Jelle J. A1 - von Der Ohe,Peter C. A1 - Wang,Zhanyun A1 - Williams,Antony J. A1 - Willighagen,Egon L. A1 - Wishart,David S. A1 - Zhang,Jian A1 - Thomaidis,Nikolaos S. A1 - Hollender,Juliane A1 - Slobodnik,Jaroslav A1 - Schymanski,Emma L. AD - Luxembourg Centre for Systems Biomedicine (LCSB), University of Luxembourg, 6 Avenue du Swing, 4367, Belvaux, Luxembourg AD - Laboratory of Analytical Chemistry, Department of Chemistry, National and Kapodistrian University of Athens, Panepistimiopolis Zografou, 15771, Athens, Greece AD - Environmental Institute, Okružná 784/42, 972 41, Koš, Slovak Republic AD - Oniris, INRAE, LABERCA, 44307, Nantes, France AD - Norwegian Geotechnical Institute (NGI), Ullevål Stadion, P.O. Box 3930, 0806, Oslo, Norway AD - Department of Chemistry, Norwegian University of Science and Technology (NTNU), 7491, Trondheim, Norway AD - Queensland Alliance for Environmental Health Sciences (QAEHS), The University of Queensland, Woolloongabba, QLD, 4102, Australia AD - Leidos, Research Triangle Park, NC, USA AD - Toxicological Centre, University of Antwerp, Antwerp, Belgium AD - Environmental and Public Health Analytical Chemistry, Research Institute for Pesticides and Water, University Jaume I, Castelló, Spain AD - National Center for Biotechnology Information, National Library of Medicine, National Institutes of Health, 8600 Rockville Pike, Bethesda, MD, 20894, USA AD - UFZ, Helmholtz Centre for Environmental Research, Leipzig, Germany AD - Institute of Ecology, Evolution and Diversity, Goethe University, Frankfurt Am Main, Germany AD - Swedish University of Agricultural Sciences (SLU), Uppsala, Sweden AD - Institute of Food Safety and Health, College of Public Health, National Taiwan University, 17 Xuzhou Rd., Zhongzheng Dist., Taipei, Taiwan AD - Faculty of Chemical and Food Technology, Institute of Information Engineering, Automation, and Mathematics, Slovak University of Technology in Bratislava (STU), Radlinského 9, 812 37, Bratislava, Slovak Republic AD - Science for Life Laboratory, Department of Environmental Science, Stockholm University, 10691, Stockholm, Sweden AD - Corteva Agriscience, Indianapolis, IN, USA AD - INERIS, National Institute for Environment and Industrial Risks, Verneuil en Halatte, France AD - Swedish Chemicals Agency (KEMI), P.O. Box 2, 172 13, Sundbyberg, Sweden AD - Institute of Environmental Assessment and Water Research-Severo Ochoa Excellence Center (IDAEA), Spanish Council of Scientific Research (CSIC), Barcelona, Spain AD - Food Packaging Forum Foundation, Staffelstrasse 10, 8045, Zurich, Switzerland AD - Institute of Biogeochemistry and Pollutant Dynamics, ETH Zurich, 8092, Zurich, Switzerland AD - Eawag, Swiss Federal Institute for Aquatic Science and Technology, Überlandstrasse 133, 8600, Dübendorf, Switzerland AD - Thermo Fisher Scientific, Dornierstrasse 4, 82110, Germering, Germany AD - Department of Chemistry, Chemical Biological Centre (KBC), Umeå University, Linnaeus Väg 6, 901 87, Umeå, Sweden AD - Department Environment and Health, Amsterdam Institute for Life and Environment, Vrije Universiteit, Amsterdam, The Netherlands AD - Water Research Institute (WRI), Nábr. Arm. Gen. L. Svobodu 5, 81249, Bratislava, Slovak Republic AD - German Environment Agency (UBA), Wörlitzer Platz 1, Dessau-Roßlau, Germany AD - Bavarian Environment Agency, 86179, Augsburg, Germany AD - Analytisches Forschungsinstitut Für Non-Target Screening GmbH (AFIN-TS), Am Mittleren Moos 48, 86167, Augsburg, Germany AD - Mass Spec Interpretation Services, 3612 Hemlock Park Drive, Kingsport, TN, 37663, USA AD - State Key Laboratory of Environmental Chemistry and Ecotoxicology, Research Center for Eco-Environmental Sciences, Chinese Academy of Sciences (SKLECE, RCEES, CAS), No. 18 Shuangqing Road, Haidian District, Beijing, 100086, China AD - Hope College, Holland, MI, 49422, USA AD - University of California, Berkeley, CA, USA AD - Agilent Technologies, Inc., 5301 Stevens Creek Blvd, Santa Clara, CA, 95051, USA AD - Department of Chemistry, Center for Innovative Technology, Vanderbilt-Ingram Cancer Center, Vanderbilt Institute of Chemical Biology, Vanderbilt Institute for Integrative Biosystems Research and Education, Vanderbilt University, Nashville, TN, 37235, USA AD - Institute for Risk Assessment Sciences (IRAS), Utrecht University, Utrecht, The Netherlands AD - University Rovira i Virgili, Tarragona, Spain AD - Biosfer Teslab, Reus, Spain AD - Nutrition and Metabolism Branch, International Agency for Research On Cancer (IARC), 150 Cours Albert Thomas, 69372, Lyon Cedex 08, France AD - RECETOX, Faculty of Science, Masaryk University, Kotlářská 2, Brno, Czech Republic AD - Institute of Legal Medicine and Core Facility Metabolomics, Medical University of Innsbruck, Muellerstrasse 44, Innsbruck, Austria AD - Technologies for Water Management and Treatment Research Group, Department of Civil Engineering, University of Granada, Campus de Fuentenueva S/N, 18071, Granada, Spain AD - Institute of Health Research Pere Virgili, Tarragona, Spain AD - Agriculture and Agri-Food Canada/Agriculture et Agroalimentaire Canada, 1391 Sandford Street, London, ON, N5V 4T3, Canada AD - NILU, Norwegian Institute for Air Research, Kjeller, Norway AD - Fraunhofer Institute for Molecular Biology and Applied Ecology (Fraunhofer IME), Schmallenberg, Germany AD - Van’t Hoff Institute for Molecular Sciences, University of Amsterdam, P.O. Box 94157, Amsterdam, 1090 GD, The Netherlands AD - Laboratory for Operation Control and Research, Zweckverband Landeswasserversorgung, Am Spitzigen Berg 1, 89129, Langenau, Germany AD - Environment Agency, Horizon House, Deanery Road, Bristol, BS1 5AH, UK AD - Chemical Contamination of Marine Ecosystems (CCEM) Unit, Institut Français de Recherche pour l’Exploitation de la Mer (IFREMER), Rue de l’Ile d’Yeu, BP 21105, 44311, Cedex 3, Nantes, France AD - Section for Environmental Chemistry and Physics, Plant and Environmental Sciences, University of Copenhagen, Thorvaldsensvej 40, 1871, Frederiksberg C, Denmark AD - Institute for Biodiversity and Ecosystem Dynamics, University of Amsterdam, Amsterdam, The Netherlands AD - Technology and Society Laboratory, Empa-Swiss Federal Laboratories for Materials Science and Technology, Lerchenfeldstrasse 5, 9014, St. Gallen, Switzerland AD - Computational Chemistry and Cheminformatics Branch (CCCB), Chemical Characterization and Exposure Division (CCED), Center for Computational Toxicology and Exposure (CCTE), United States Environmental Protection Agency, 109 T.W. Alexander Drive, Research Triangle Park, NC, 27711, USA AD - Department of Bioinformatics-BiGCaT, NUTRIM, Maastricht University, Maastricht, The Netherlands AD - University of Alberta, Edmonton, AB, T6G 2G3, Canada UR - https://archimer.ifremer.fr/doc/00799/91145/ DO - 10.1186/s12302-022-00680-6 KW - Suspect screening KW - High resolution mass spectrometry KW - Non-target screening KW - Open science KW - FAIR (Findable Accessible Interoperable Reusable) data KW - Data exchange KW - Cheminformatics KW - Exposomics KW - Environmental contaminants KW - Chemicals of emerging concern N2 - Background The NORMAN Association (https://www.norman-network.com/) initiated the NORMAN Suspect List Exchange (NORMAN-SLE; https://www.norman-network.com/nds/SLE/) in 2015, following the NORMAN collaborative trial on non-target screening of environmental water samples by mass spectrometry. Since then, this exchange of information on chemicals that are expected to occur in the environment, along with the accompanying expert knowledge and references, has become a valuable knowledge base for “suspect screening” lists. The NORMAN-SLE now serves as a FAIR (Findable, Accessible, Interoperable, Reusable) chemical information resource worldwide. Results The NORMAN-SLE contains 99 separate suspect list collections (as of May 2022) from over 70 contributors around the world, totalling over 100,000 unique substances. The substance classes include per- and polyfluoroalkyl substances (PFAS), pharmaceuticals, pesticides, natural toxins, high production volume substances covered under the European REACH regulation (EC: 1272/2008), priority contaminants of emerging concern (CECs) and regulatory lists from NORMAN partners. Several lists focus on transformation products (TPs) and complex features detected in the environment with various levels of provenance and structural information. Each list is available for separate download. The merged, curated collection is also available as the NORMAN Substance Database (NORMAN SusDat). Both the NORMAN-SLE and NORMAN SusDat are integrated within the NORMAN Database System (NDS). The individual NORMAN-SLE lists receive digital object identifiers (DOIs) and traceable versioning via a Zenodo community (https://zenodo.org/communities/norman-sle), with a total of > 40,000 unique views, > 50,000 unique downloads and 40 citations (May 2022). NORMAN-SLE content is progressively integrated into large open chemical databases such as PubChem (https://pubchem.ncbi.nlm.nih.gov/) and the US EPA’s CompTox Chemicals Dashboard (https://comptox.epa.gov/dashboard/), enabling further access to these lists, along with the additional functionality and calculated properties these resources offer. PubChem has also integrated significant annotation content from the NORMAN-SLE, including a classification browser (https://pubchem.ncbi.nlm.nih.gov/classification/#hid=101). Conclusions The NORMAN-SLE offers a specialized service for hosting suspect screening lists of relevance for the environmental community in an open, FAIR manner that allows integration with other major chemical resources. These efforts foster the exchange of information between scientists and regulators, supporting the paradigm shift to the “one substance, one assessment” approach. New submissions are welcome via the contacts provided on the NORMAN-SLE website (https://www.norman-network.com/nds/SLE/). Y1 - 2022/12 PB - Springer Science and Business Media LLC JF - Environmental Sciences Europe SN - 2190-4707 VL - 34 IS - 1 ID - 91145 ER -