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The polypharmacology browser: a web-based multi-fingerprint target prediction tool using ChEMBL bioactivity data
BACKGROUND: Several web-based tools have been reported recently which predict the possible targets of a small molecule by similarity to compounds of known bioactivity using molecular fingerprints (fps), however predictions in each case rely on similarities computed from only one or two fps. Consider...
| Autores principales: | , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
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Springer International Publishing
2017
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5319934/ https://www.ncbi.nlm.nih.gov/pubmed/28270862 http://dx.doi.org/10.1186/s13321-017-0199-x |