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Volumn 8, Issue , 2010, Pages 367-382

The role of qsar methodology in the regulatory assessment of chemicals

Author keywords

and adequacy of QSAR; Applicability; REACH; Regulatory assessment; Validity

Indexed keywords


EID: 85073142597     PISSN: 25424491     EISSN: 25424483     Source Type: Book Series    
DOI: 10.1007/978-1-4020-9783-6_13     Document Type: Chapter
Times cited : (45)

References (49)
  • 2
    • 85073157711 scopus 로고    scopus 로고
    • European Commission (2006b) Directive 2006/121/EC of the European Parliament and of the Council of 18 December 2006 amending Council Directive 67/548/EEC on the approximation of laws, regulations and administrative provisions relating to the classification, packaging and labelling of dangerous substances in order to adapt it to Regulation (EC) No 1907/2006 concerning the Registration, Evaluation, Authorisation and Restriction of Chemicals (REACH) and establishing a European Chemicals Agency. Official Journal of the European Union, L 396/850 of 30.12.2006. Office for Official Publications of the European Communities (OPOCE), Luxembourg
    • European Commission (2006b) Directive 2006/121/EC of the European Parliament and of the Council of 18 December 2006 amending Council Directive 67/548/EEC on the approximation of laws, regulations and administrative provisions relating to the classification, packaging and labelling of dangerous substances in order to adapt it to Regulation (EC) No 1907/2006 concerning the Registration, Evaluation, Authorisation and Restriction of Chemicals (REACH) and establishing a European Chemicals Agency. Official Journal of the European Union, L 396/850 of 30.12.2006. Office for Official Publications of the European Communities (OPOCE), Luxembourg
  • 3
    • 85073149375 scopus 로고    scopus 로고
    • European Commission (1998) Directive 98/8/EC of the European Parliament and of the Council of 16 February 1998 concerning the placing of biocidal products on the market. Official Journal of the European Union, L 132/1 of 24.04.1998. Office for Official Publications of the European Communities (OPOCE), Luxembourg
    • European Commission (1998) Directive 98/8/EC of the European Parliament and of the Council of 16 February 1998 concerning the placing of biocidal products on the market. Official Journal of the European Union, L 132/1 of 24.04.1998. Office for Official Publications of the European Communities (OPOCE), Luxembourg
  • 4
    • 85073153705 scopus 로고    scopus 로고
    • European Commission (1991) Council Directive 91/414/EEC of 15 July 1991 concerning the placing of plant protection products on the market. Official Journal of the European Union, L 230/1 of 19.08.1991. Office for Official Publications of the European Communities (OPOCE), Luxembourg
    • European Commission (1991) Council Directive 91/414/EEC of 15 July 1991 concerning the placing of plant protection products on the market. Official Journal of the European Union, L 230/1 of 19.08.1991. Office for Official Publications of the European Communities (OPOCE), Luxembourg
  • 5
    • 85073161301 scopus 로고    scopus 로고
    • European Commission (2000) Directive 2000/60/EC of the European Parliament and of the Council of 23 October 2000 establishing a framework for the Community action in the field of water policy. Official Journal of the European Union, L 327/1 of 22.12.2000. Office for Official Publications of the European Communities (OPOCE), Luxembourg
    • European Commission (2000) Directive 2000/60/EC of the European Parliament and of the Council of 23 October 2000 establishing a framework for the Community action in the field of water policy. Official Journal of the European Union, L 327/1 of 22.12.2000. Office for Official Publications of the European Communities (OPOCE), Luxembourg
  • 6
    • 85073166374 scopus 로고    scopus 로고
    • European Commission (1976) Council Directive 76/768 of 27 July 1976 on the approximation of the laws of the Member States relating to cosmetic products. Official Journal of the European Union, L 262/169 of 27.09.1976. Office for Official Publications of the European Communities (OPOCE), Luxembourg
    • European Commission (1976) Council Directive 76/768 of 27 July 1976 on the approximation of the laws of the Member States relating to cosmetic products. Official Journal of the European Union, L 262/169 of 27.09.1976. Office for Official Publications of the European Communities (OPOCE), Luxembourg
  • 7
    • 38849115032 scopus 로고    scopus 로고
    • Intelligent testing strategies
    • Van Leeuwen CJ, Vermeire TG, 2nd edn. Springer Publishers, Dordrecht, The Netherlands, pp
    • Van Leeuwen CJ, Patlewicz GY, Worth AP (2007) Intelligent testing strategies. In: Van Leeuwen CJ, Vermeire TG (eds) Risk assessment of chemicals. An introduction, 2nd edn. Springer Publishers, Dordrecht, The Netherlands, pp 46–509
    • (2007) Risk Assessment of Chemicals. an Introduction , pp. 46-509
    • van Leeuwen, C.J.1    Patlewicz, G.Y.2    Worth, A.P.3
  • 8
    • 33748577206 scopus 로고    scopus 로고
    • Integrated testing strategies for use in the EU REACH system
    • Grindon C, Combes R, Cronin MT et al. (2006) Integrated testing strategies for use in the EU REACH system. ATLA 34:407–427
    • (2006) ATLA , vol.34 , pp. 407-427
    • Grindon, C.1    Combes, R.2    Cronin, M.T.3
  • 9
    • 47049123953 scopus 로고    scopus 로고
    • A feasibility study developing an integrated testing strategy assessing skin irritation potential of chemicals
    • Hoffmann S, Gallegos Saliner A, Patlewicz G et al. (2008) A feasibility study developing an integrated testing strategy assessing skin irritation potential of chemicals. Toxicol Lett 180:9–20
    • (2008) Toxicol Lett , vol.180 , pp. 9-20
    • Hoffmann, S.1    Gallegos Saliner, A.2    Patlewicz, G.3
  • 10
    • 33749680786 scopus 로고    scopus 로고
    • Quantitative structure–activity–activity and quantitative structure–activity investigations of human and rodent toxicity
    • Lessigiarska IV, Worth AP, Netzeva TI et al. (2006) Quantitative structure–activity–activity and quantitative structure–activity investigations of human and rodent toxicity. Chemosphere 65: 1878–1887
    • (2006) Chemosphere , vol.65 , pp. 1878-1887
    • Lessigiarska, I.V.1    Worth, A.P.2    Netzeva, T.I.3
  • 11
    • 0001383515 scopus 로고    scopus 로고
    • The development and validation of expert systems for predicting toxicity. The report and recommendations of an ECVAM/ECB workshop (ECVAM workshop 24)
    • Dearden JC, Barratt MD, Benigni R et al. (1997) The development and validation of expert systems for predicting toxicity. The report and recommendations of an ECVAM/ECB workshop (ECVAM workshop 24). ATLA 25:223–252
    • (1997) ATLA , vol.25 , pp. 223-252
    • Dearden, J.C.1    Barratt, M.D.2    Benigni, R.3
  • 17
    • 47349112107 scopus 로고    scopus 로고
    • Toxmatch – a new software tool to aid in the development and evaluation of chemically similar groups
    • Patlewicz G, Jeliazkova N, Gallegos Saliner A et al. (2008) Toxmatch – a new software tool to aid in the development and evaluation of chemically similar groups. SAR QSAR Environ Res 19:397–412
    • (2008) SAR QSAR Environ Res , vol.19 , pp. 397-412
    • Patlewicz, G.1    Jeliazkova, N.2    Gallegos Saliner, A.3
  • 18
    • 55949109925 scopus 로고    scopus 로고
    • Toxmatch – A chemical classification and activity prediction tool based on similarity measures
    • Gallegos Saliner A, Poater A, Jeliazkova N et al. (2008) Toxmatch – A chemical classification and activity prediction tool based on similarity measures. Regul Toxicol Pharmacol 52:77–84
    • (2008) Regul Toxicol Pharmacol , vol.52 , pp. 77-84
    • Gallegos Saliner, A.1    Poater, A.2    Jeliazkova, N.3
  • 21
    • 38849099043 scopus 로고    scopus 로고
    • The integrated use of models for the properties and effects of chemicals by means of a structured workflow
    • Bassan A, Worth AP (2008) The integrated use of models for the properties and effects of chemicals by means of a structured workflow. QSAR Comb Sci 27:6–20
    • (2008) QSAR Comb Sci , vol.27 , pp. 6-20
    • Bassan, A.1    Worth, A.P.2
  • 24
    • 0012906771 scopus 로고    scopus 로고
    • Summary of a workshop on regulatory acceptance of (Q)SARs for human health and environmental endpoints
    • Jaworska JS, Comber M, Auer C et al. (2003) Summary of a workshop on regulatory acceptance of (Q)SARs for human health and environmental endpoints. Environ Health Perspect 111:1358–1360
    • (2003) Environ Health Perspect , vol.111 , pp. 1358-1360
    • Jaworska, J.S.1    Comber, M.2    Auer, C.3
  • 25
    • 0043132440 scopus 로고    scopus 로고
    • Methods for reliability, uncertainty assessment, and applicability evaluations of classification and regression based QSARs
    • Eriksson L, Jaworska JS, Worth AP et al. (2003) Methods for reliability, uncertainty assessment, and applicability evaluations of classification and regression based QSARs. Environ Health Perspect 111:1361–1375
    • (2003) Environ Health Perspect , vol.111 , pp. 1361-1375
    • Eriksson, L.1    Jaworska, J.S.2    Worth, A.P.3
  • 26
    • 0012959393 scopus 로고    scopus 로고
    • Use of quantitative structure-activity relationships in international decision-making frameworks to predict ecologic effects and environmental fate of chemical substances
    • Cronin MTD, Walker JD, Jaworska JS et al. (2003) Use of quantitative structure-activity relationships in international decision-making frameworks to predict ecologic effects and environmental fate of chemical substances. Environ Health Perspect 111:1376–1390
    • (2003) Environ Health Perspect , vol.111 , pp. 1376-1390
    • Cronin, M.T.D.1    Walker, J.D.2    Jaworska, J.S.3
  • 27
    • 0003302467 scopus 로고    scopus 로고
    • Use of quantitative structure-activity relationships in international decision-making frameworks to predict health effects of chemical substances
    • Cronin MTD, Jaworska JS, Walker J et al. (2003) Use of quantitative structure-activity relationships in international decision-making frameworks to predict health effects of chemical substances. Environ Health Perspect 111:1391–1401
    • (2003) Environ Health Perspect , vol.111 , pp. 1391-1401
    • Cronin, M.T.D.1    Jaworska, J.S.2    Walker, J.3
  • 28
    • 85073149218 scopus 로고    scopus 로고
    • JRC QSAR Model Database
    • JRC QSAR Model Database. http://qsardb.jrc.it
  • 29
    • 21044448353 scopus 로고    scopus 로고
    • Current status of methods for defining the applicability domain of (Quantitative) structure-activity relationships. The report and recommendations of ECVAM workshop 52
    • Netzeva TI, Worth AP Aldenberg T et al. (2005) Current status of methods for defining the applicability domain of (quantitative) structure-activity relationships. The report and recommendations of ECVAM workshop 52. ATLA 33:155–173
    • (2005) ATLA , vol.33 , pp. 155-173
    • Netzeva, T.I.1    Worth Ap Aldenberg, T.2
  • 30
    • 38849181634 scopus 로고    scopus 로고
    • Review of estimation models for biodegradation
    • Pavan M, Worth AP (2008) Review of estimation models for biodegradation. QSAR Comb Sci 27:32–40
    • (2008) QSAR Comb Sci , vol.27 , pp. 32-40
    • Pavan, M.1    Worth, A.P.2
  • 31
    • 38849134167 scopus 로고    scopus 로고
    • A minireview of available skin sensitization (Q)SARs/expert systems
    • Patlewicz G, Aptula AO, Roberts DW, Uriarte E (2008) A minireview of available skin sensitization (Q)SARs/expert systems. QSAR Comb Sci 27:60–76
    • (2008) QSAR Comb Sci , vol.27 , pp. 60-76
    • Patlewicz, G.1    Aptula, A.O.2    Roberts, D.W.3    Uriarte, E.4
  • 32
    • 33847068743 scopus 로고    scopus 로고
    • The role of the European Chemicals Bureau in promoting the regulatory use of (Q)SAR methods
    • Worth AP, Bassan A, de Bruijn J et al. (2007) The role of the European Chemicals Bureau in promoting the regulatory use of (Q)SAR methods. SAR QSAR Environ Res 18:111–125
    • (2007) SAR QSAR Environ Res , vol.18 , pp. 111-125
    • Worth, A.P.1    Bassan, A.2    de Bruijn, J.3
  • 33
    • 85073145988 scopus 로고    scopus 로고
    • JRC QSAR Tools
    • JRC QSAR Tools. http://ecb.jrc.ec.europa.eu/qsar/qsar-tools/
  • 34
    • 85073169999 scopus 로고    scopus 로고
    • OECD QSAR Application Toolbox
    • OECD QSAR Application Toolbox. http://www.oecd.org/env/existingchemicals/qsar/
  • 35
    • 85073156449 scopus 로고    scopus 로고
    • AMBIT Software. http://sourceforge.net/projects/ambit/
    • AMBIT Software
  • 36
    • 57349116331 scopus 로고    scopus 로고
    • Publicly-accessible QSAR software tools developed by the Joint Research Centre
    • Pavan M, Worth A (2008) Publicly-accessible QSAR software tools developed by the Joint Research Centre. SAR QSAR Environ Res 19:785–799
    • (2008) SAR QSAR Environ Res , vol.19 , pp. 785-799
    • Pavan, M.1    Worth, A.2
  • 37
    • 50049090548 scopus 로고    scopus 로고
    • Classification of chemicals according to mechanism of aquatic toxicity: An evaluation of the implementation of the Verhaar scheme in Toxtree
    • Enoch SJ, Hewitt M, Cronin MT et al. (2008) Classification of chemicals according to mechanism of aquatic toxicity: An evaluation of the implementation of the Verhaar scheme in Toxtree. Chemosphere 73:243–248
    • (2008) Chemosphere , vol.73 , pp. 243-248
    • Enoch, S.J.1    Hewitt, M.2    Cronin, M.T.3
  • 39
    • 47349112107 scopus 로고    scopus 로고
    • An evaluation of the implementation of the Cramer classification scheme in the Toxtree software
    • Patlewicz G, Jeliazkova N, Safford RJ et al. (2008) An evaluation of the implementation of the Cramer classification scheme in the Toxtree software. SAR QSAR Environ Res 19:397–412
    • (2008) SAR QSAR Environ Res , vol.19 , pp. 397-412
    • Patlewicz, G.1    Jeliazkova, N.2    Safford, R.J.3
  • 41
    • 34250000327 scopus 로고    scopus 로고
    • Proposed integrated decision-tree testing strategies for mutagenicity and carcinogenicity in relation to the EU REACH legislation
    • Combes R, Grindon C, Cronin MT et al. (2007) Proposed integrated decision-tree testing strategies for mutagenicity and carcinogenicity in relation to the EU REACH legislation. ATLA 35:267–287
    • (2007) ATLA , vol.35 , pp. 267-287
    • Combes, R.1    Grindon, C.2    Cronin, M.T.3
  • 42
    • 38649114341 scopus 로고    scopus 로고
    • Integrated decision-tree testing strategies for skin corrosion and irritation with respect to the requirements of the EU REACH legislation
    • Grindon C, Combes R, Cronin MT et al. (2007a) Integrated decision-tree testing strategies for skin corrosion and irritation with respect to the requirements of the EU REACH legislation. ATLA 35:673–682
    • (2007) ATLA , vol.35 , pp. 673-682
    • Grindon, C.1    Combes, R.2    Cronin, M.T.3
  • 43
    • 38649099696 scopus 로고    scopus 로고
    • An integrated decision-tree testing strategy for skin sensitisation with respect to the requirements of the EU REACH legislation
    • Grindon C, Combes R, Cronin MT et al. (2007b) An integrated decision-tree testing strategy for skin sensitisation with respect to the requirements of the EU REACH legislation. ATLA 35:683–697
    • (2007) ATLA , vol.35 , pp. 683-697
    • Grindon, C.1    Combes, R.2    Cronin, M.T.3
  • 44
    • 85138944314 scopus 로고    scopus 로고
    • Integrated decision-tree testing strategies for acute systemic toxicity and toxicokinetics with respect to the requirements of the EU REACH legislation
    • Combes R, Grindon C, Cronin MT et al. (2008) Integrated decision-tree testing strategies for acute systemic toxicity and toxicokinetics with respect to the requirements of the EU REACH legislation. ATLA 36:45–63
    • (2008) ATLA , vol.36 , pp. 45-63
    • Combes, R.1    Grindon, C.2    Cronin, M.T.3
  • 45
    • 41149151278 scopus 로고    scopus 로고
    • Integrated decision-tree testing strategies for developmental and reproductive toxicity with respect to the requirements of the EU REACH legislation
    • Grindon C, Combes R, Cronin MT et al. (2008a) Integrated decision-tree testing strategies for developmental and reproductive toxicity with respect to the requirements of the EU REACH legislation. ATLA 36:65–80
    • (2008) ATLA , vol.36 , pp. 65-80
    • Grindon, C.1    Combes, R.2    Cronin, M.T.3
  • 46
    • 41149150239 scopus 로고    scopus 로고
    • An integrated decision-tree testing strategy for eye irritation with respect to the requirements of the EU REACH legislation
    • Grindon C, Combes R, Cronin MT et al. (2008b) An integrated decision-tree testing strategy for eye irritation with respect to the requirements of the EU REACH legislation. ATLA 36:81–92
    • (2008) ATLA , vol.36 , pp. 81-92
    • Grindon, C.1    Combes, R.2    Cronin, M.T.3
  • 47
    • 41149121608 scopus 로고    scopus 로고
    • An integrated decision-tree testing strategy for repeat dose toxicity with respect to the requirements of the EU REACH legislation
    • Grindon C, Combes R, Cronin MT et al. (2008c) An integrated decision-tree testing strategy for repeat dose toxicity with respect to the requirements of the EU REACH legislation. ATLA 36: 93–101
    • (2008) ATLA , vol.36 , pp. 93-101
    • Grindon, C.1    Combes, R.2    Cronin, M.T.3
  • 49
    • 85073144841 scopus 로고    scopus 로고
    • OSIRIS Project
    • OSIRIS Project http://www.osiris-reach.eu/


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