Improvement of quantitative structure–activity relationship (QSAR) tools for predicting Ames mutagenicity: outcomes of the Ames/QSAR International Challenge Project

Author:

Honma Masamitsu1,Kitazawa Airi1,Cayley Alex2,Williams Richard V2,Barber Chris2,Hanser Thierry2,Saiakhov Roustem3,Chakravarti Suman3,Myatt Glenn J4,Cross Kevin P4,Benfenati Emilio5,Raitano Giuseppa5,Mekenyan Ovanes6,Petkov Petko6,Bossa Cecilia7,Benigni Romualdo78,Battistelli Chiara Laura7,Giuliani Alessandro7,Tcheremenskaia Olga7,DeMeo Christine9,Norinder Ulf1011,Koga Hiromi12,Jose Ciloy12,Jeliazkova Nina13,Kochev Nikolay1314,Paskaleva Vesselina14,Yang Chihae15,Daga Pankaj R16,Clark Robert D16,Rathman James1517

Affiliation:

1. Division of Genetics and Mutagenesis, National Institute of Health Sciences, Tonomachi, Kawasaki-ku, Kanagawa, Japan

2. Lhasa Limited, Granary Wharf House, Canal Wharf, Leeds, UK

3. MultiCASE Inc., Chagrin Blvd Ste, Beachwood, OH, USA

4. Leadscope, Inc., Columbus, OH, USA

5. Istituto di Ricerche Farmacologiche Mario Negri IRCCS, Via G. La Masa19 Milano, Italy

6. Laboratory of Mathematical Chemistry, As. Zlatarov University, Bourgas, Bulgaria

7. Istituto Superiore di Sanita’, Viale Regina Elena, Rome, Italy

8. Alpha-Pretox, Via G. Pascoli, Rome, Italy

9. Prous Institute, Rambla de Catalunya, Barcelona, Spain

10. Swetox, Karolinska Institutet, Unit of Toxicology Sciences, Södertälje, Sweden

11. Department of Computer and Systems Sciences, Stockholm University, SE Kista, Sweden

12. Fujitsu Kyushu Systems Limited, Higashihie, Hakata-ku, Fukuoka, Japan

13. IdeaConsult Ltd., A. Kanchev str., Sofia, Bulgaria

14. Department of Analytical Chemistry and Computer Chemistry, University of Plovdiv, Plovdiv, Bulgaria

15. Molecular Networks GmbH and Altamira LLC, Neumeyerstrasse Nürnberg, Germany and Candlewood Drive, Columbus, OH, USA

16. Simulations Plus, Inc., CA, USA

17. Chemical and Biomolecular Engineering, The Ohio State University, W. Woodruff Ave. Columbus, OH, USA

Funder

Health and Labor Sciences Research

Publisher

Oxford University Press (OUP)

Subject

Health, Toxicology and Mutagenesis,Genetics (clinical),Toxicology,Genetics

Reference44 articles.

1. Review of QSAR models and software tools for predicting genotoxicity and carcinogenicity;Serafimova;JRC Scientific and Technical Reports,2010

2. The Ames Salmonella/microsome mutagenicity assay;Mortelmans;Mutat. Res,2000

3. Ultimate chemical carcinogen as reactive mutagenic electorophiles;Miller,1977

4. The value and limitations of short-term genotoxicity assays and the inadequacy of current cancer bioassay chemical selection criteria;Ashby;Ann. N. Y. Acad. Sci,1988

5. Determination of the genotoxic status of a chemical;Ashby;Mutat. Res,1991

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