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3D Chemical Similarity Networks for Structure-Based Target Prediction and Scaffold Hopping
Target identification remains a major challenge for modern drug discovery programs aimed at understanding the molecular mechanisms of drugs. Computational target prediction approaches like 2D chemical similarity searches have been widely used but are limited to structures sharing high chemical simil...
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| Publicat a: | ACS Chem Biol |
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| Autors principals: | , , , |
| Format: | Artigo |
| Idioma: | Inglês |
| Publicat: |
2016
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| Matèries: | |
| Accés en línia: | https://ncbi.nlm.nih.gov/pmc/articles/PMC5511031/ https://ncbi.nlm.nih.gov/pubmed/27285961 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acschembio.6b00253 |
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