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Investigating the correlations among the chemical structures, bioactivity profiles and molecular targets of small molecules
Motivation: Most of the previous data mining studies based on the NCI-60 dataset, due to its intrinsic cell-based nature, can hardly provide insights into the molecular targets for screened compounds. On the other hand, the abundant information of the compound–target associations in PubChem can offe...
| Autores principales: | , , |
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| Formato: | Texto |
| Lenguaje: | English |
| Publicado: |
Oxford University Press
2010
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2971579/ https://www.ncbi.nlm.nih.gov/pubmed/20947527 http://dx.doi.org/10.1093/bioinformatics/btq550 |