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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...
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| Publicado no: | J Cheminform |
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| Main Authors: | , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
Springer International Publishing
2017
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC5319934/ https://ncbi.nlm.nih.gov/pubmed/28270862 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1186/s13321-017-0199-x |
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