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H-RACS: a handy tool to rank anti-cancer synergistic drugs
- Source :
- Aging (Albany NY)
- Publication Year :
- 2020
- Publisher :
- Impact Journals, LLC, 2020.
-
Abstract
- Though promising, identifying synergistic combinations from a large pool of candidate drugs remains challenging for cancer treatment. Due to unclear mechanism and limited confirmed cases, only a few computational algorithms are able to predict drug synergy. Yet they normally require the drug-cell treatment results as an essential input, thus exclude the possibility to pre-screen those unexplored drugs without cell treatment profiling. Based on the largest dataset of 33,574 combinational scenarios, we proposed a handy webserver, H-RACS, to overcome the above problems. Being loaded with chemical structures and target information, H-RACS can recommend potential synergistic pairs between candidate drugs on 928 cell lines of 24 prevalent cancer types. A high model performance was achieved with AUC of 0.89 on independent combinational scenarios. On the second independent validation of DREAM dataset, H-RACS obtained precision of 67% among its top 5% ranking list. When being tested on new combinations and new cell lines, H-RACS showed strong extendibility with AUC of 0.84 and 0.81 respectively. As the first online server freely accessible at http://www.badd-cao.net/h-racs, H-RACS may promote the pre-screening of synergistic combinations for new chemical drugs on unexplored cancers.
- Subjects :
- Aging
drug synergy
web server
Molecular Structure
Databases, Pharmaceutical
Computer science
Reproducibility of Results
Antineoplastic Agents
Drug Synergism
bioinformatics
Cell Biology
Computational biology
Treatment results
Synergistic combination
Cancer treatment
Machine Learning
Structure-Activity Relationship
synergistic combination
Cell Line, Tumor
Neoplasms
Antineoplastic Combined Chemotherapy Protocols
Humans
anti-cancer
Research Paper
Subjects
Details
- ISSN :
- 19454589
- Volume :
- 12
- Database :
- OpenAIRE
- Journal :
- Aging
- Accession number :
- edsair.doi.dedup.....42bbe1a2e89f01ca4200eb60a7ed0aee
- Full Text :
- https://doi.org/10.18632/aging.103925