Sanjiv K. Jha

Toxicity by Consortium Revisited: Structural Neighbors and Cross-Family Reach

A compound’s toxicity can be gauged from the toxicities of the compounds it resembles. We showed that in 2003 for rat oral LD50: the compounds in a reference set of 13,645 that most resemble the query form a consortium and vote on its toxicity1. This work returns to that method twenty-three years later, on public data,...