Data Mining Approach for Extraction of Useful Information About Biologically Active Compounds from Publications.

ABSTRACT: A lot of high quality data on the biological activity of chemical compounds are required throughout the whole drug discovery process: from development of computational models of the structure-activity relationship to experimental testing of lead compounds and their validation in clinics. Currently, a large amount of such data is available from databases, scientific publications, and patents. Biological data are characterized by incompleteness, uncertainty, and low reproducibility. Despite the existence of free and commercially available databases of biological activities of compounds, they usually lack unambiguous information about peculiarities of biological assays. On the other hand, scientific papers are the primary source of new data disclosed to the scientific community for the first

SUBMITTER: Tarasova OA 

PROVIDER: S-EPMC8194363 | biostudies-literature | 2019 Sep

REPOSITORIES: biostudies-literature