R. Benigni et al., PREDICTION OF RODENT CARCINOGENICITY OF FURTHER 30 CHEMICALS BIOASSAYED BY THE US NATIONAL TOXICOLOGY PROGRAM, Environmental health perspectives, 104, 1996, pp. 1041-1044
Recently the U.S. National Toxicology Program (NTP) sponsored a compar
ative exercise in which different prediction approaches (both biologic
ally and chemically based) were challenged for their predictive abilit
ies of rodent carcinogenicity of a common set of chemicals. The exerci
se enjoyed remarkable scientific success and stimulated NTP to sponsor
a second challenging round of tests, inviting participants to present
predictions relative to the rodent carcinogenicity of a further 30 ch
emicals; these are currently being tested. In this article, we present
our predictions based on structure-activity relationship consideratio
ns. In our procedure, first each chemical was assigned to an activity
mechanism class and then, with semiquantitative considerations, was as
signed a probability carcinogenicity score, taking into account simult
aneously the hypothesized action mechanism and physical chemical param
eters.