QSAR Drug
Side Effect Predictor
End-to-end drug adverse effect prediction system for early-stage drug safety screening. Multi-label classifier trained on ChEMBL + SIDER across 15 adverse effect labels. Molecular featurisation using Morgan fingerprints (r2-r5) and 14 RDKit physicochemical descriptors. Weighted loss for class imbalance; atom-level SHAP interpretability for clinical explainability. Full-stack deployment with Flask REST API and JavaScript frontend.
15 AE labels · SHAP interpretability · Flask + JS