Table 1 The comparative study of the current drug combination strategies and the applied dataset.

From: Harnessing machine learning to find synergistic combinations for FDA-approved cancer drugs

Author/year

Dataset used

Algorithm

Problem statement

Major contribution

Pros

Recommendation

Sun et al.36

DCDB 2.0 drug combination database42

Semi-supervised learning

It exhibits an Anti-Cancer Synergy Ranking System (RACS)

They got a probability concordance of 0.78

Synergy prediction and significantly minimize experimental prescreening of current pharmaceuticals for repurposing to cancer treatment

One prediction is confirmed in vivo in a zebrafish MCF7 xenograft model, suggesting great synergy and minimal toxicity. The approach was validated using A549 lung cancer cells

Li et al.37

Dream43

Random Forest

The goal of synergistic drug combinations is to find new ways to treat cancer

Drug chemical structure, drug target network, and pharmacogenomics features all have an effect

Three of the 28 anti-cancer drug combinations identified by the prediction algorithm were effective

The use of a prediction model could assist in narrowing the search area and speed up the discovery of clinically effective synergistic medication combinations

Xia et al.44

NCI-ALMANAC45

Deep Learning

Predicting the response of a selection of medication combinations in cell lines

Predicting tumor progression. While they achieve the greatest results using a combination of molecular feature types

Based on the model's expected combination, they rate the medicine combos for each cell line

They demonstrate promising results in predicting combinational medication response using deep learning

Malyutina et al.39

O'Neil46

Elastic Net, Random Forest, Support Vector Machine

Combinations in cancer have been aided by high-throughput drug screening

Cross-design to medication combination sensitivity and synergy testing

S synergy score was created by comparing the dose–response of a drug combination to a single drug dose–response

Overall, they proved the effectiveness of combining cross-design with CSS sensitivity and S synergy rating

Jiang et al.40

O’Neil46

Graph Convolutional Network

A combination of various networks to predict synergistic medication combinations

The GCN model for predicting synergistic medication combinations in specific cancer cell lines in this study. The GCN technique

Using a large heterogonous network, the GCN model was able to correctly predict cell line-specific synergistic drug combinations

Predicting and optimizing synergistic medication pairings in silico

Liu et al.41

O’Neil46

Transformer boosted Deep Learning

Drug combinations have shown considerable promise in the treatment of cancer

An improved deep learning model for drug combination prediction that enhances performance and interpretability. Through gene–gene interaction, cell-line gene reliance, and genome-wide drug-target interaction

In comprehensive benchmark testing, TranSynergy beats the state-of-the-art approach

Identify biomarkers for precision medicine. For ovarian cancer, which has few therapy choices