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.

PMID: 35586666
PMCID: PMC9110191
Funding: - National Natural Science Foundation of China: 61772028, 61911540482