Screen Multiple
Drug Candidates
Upload a CSV of SMILES strings and rank the entire batch by composite ADMET score, side by side.
Shotgun Protocol
Tool Prediction Collection: Gathering ADMET predictions from 6 independent tools (ADMETlab3, Deep-PK, pkCSM, ADMET-AI, PHD Predictor, SwissADME).
Bayesian Ensemble: Bayesian inference distills the tools' raw outputs into 7 ADMET and BBB properties.
Probabilistic Confidence: Results include uncertainty intervals representing the model's confidence in specific chemotypes.
ADMET Profiling: Scoring Absorption, Distribution, Metabolism, Excretion, Toxicity, BBB penetration, and FDA cousin matching against ~12k FDA-approved & clinical-trial drugs.
Multi-Candidate Ranking: All candidates are ranked by composite ADMET so the highest-scoring candidates appear at the top of the table.