Data Curation can Improve the Prediction Accuracy of Metabolic Intrinsic Clearance.
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ABSTRACT:
SUBMITTER: Esaki T
PROVIDER: S-EPMC6586005 | biostudies-literature | 2019 Jan
REPOSITORIES: biostudies-literature
Publications
Data Curation can Improve the Prediction Accuracy of Metabolic Intrinsic Clearance.
Esaki Tsuyoshi T Watanabe Reiko R Kawashima Hitoshi H Ohashi Rikiya R Natsume-Kitatani Yayoi Y Nagao Chioko C Mizuguchi Kenji K
Molecular informatics 20180924 1-2
A key consideration at the screening stages of drug discovery is in vitro metabolic stability, often measured in human liver microsomes. Computational prediction models can be built using a large quantity of experimental data available from public databases, but these databases typically contain data measured using various protocols in different laboratories, raising the issue of data quality. In this study, we retrieved the intrinsic clearance (CL<sub>int</sub> ) measurements from an open datab ...[more]
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