DDIPF
DDIPF predicts probabilities of drug-drug interactions using drug fingerprint-based representations to assess safety in combination therapies.
Key Features:
- Drug fingerprint features: Represents drugs using drug fingerprint features for interaction modeling.
- Combination operators: Generates interaction representations using addition, subtraction, and Hadamard models.
- Representation scheme: Employs a straightforward sample scheme for representing DDIs rather than complex algorithm-derived features.
- Classifier: Applies a random forest classifier for DDI prediction.
- Validation: Evaluates predictive performance using tenfold cross-validation.
- Prediction scope: Predicts interactions among known-known, known-unknown, and unknown-unknown drug pairs.
Scientific Applications:
- Drug-drug interaction prediction: Prediction of adverse drug-drug interactions to support safety assessment in combination therapies.
- Novel interaction discovery: Identification of novel DDIs among known and unknown compounds.
- Pharmacovigilance and regimen optimization: Supporting pharmacovigilance and optimization of combination drug regimens.
Methodology:
Represents drugs with fingerprint features, constructs interaction features via addition, subtraction, and Hadamard operations, classifies pairs with a random forest, and assesses performance using tenfold cross-validation.
Topics
Details
- License:
- Not licensed
- Tool Type:
- web application
- Operating Systems:
- Mac, Linux, Windows
- Added:
- 8/15/2022
- Last Updated:
- 11/24/2024
Operations
Publications
Ran B, Chen L, Li M, Han Y, Dai Q. Drug-Drug Interactions Prediction Using Fingerprint Only. Computational and Mathematical Methods in Medicine. 2022;2022:1-14. doi:10.1155/2022/7818480. PMID:35586666. PMCID:PMC9110191.
DOI: 10.1155/2022/7818480
PMID: 35586666
PMCID: PMC9110191
Funding: - National Natural Science Foundation of China: 61772028, 61911540482