PredTox

Predictive Toxicology Platform

PredTox
PredTox app showcased on a desktop, highlighting its sleek design and key functionalities in a clean, modern interface.
Predictive Toxicology Platform

Product Overview



Multimodality platform for predicting in-vivo toxicity across compounds, reducing the need for animal studies and accelerating the drug discovery process.

Disclaimer: Unless otherwise stated, all products are “Research Use Only”; not for use in diagnostic procedures.
Overcome the Limitations of Traditional Toxicity Testing
 

Testing hundreds of animals at increasing concentrations is cumbersome and resource-intensive
Results often fail to translate well to human studies, causing delays and wasted resources
Regulatory and ethical pressures emphasize the 3Rs: Reduce, Refine, and Replace animal use in research

PredTox offers accurate in-vivo toxicity predictions, accelerates development, and ensures ethical compliance by minimizing animal testing

Features

Multi-Modality Integration

Analyze multiple data sources, including SMILES, for comprehensive insights into potential toxicity.
Flowchart: chemical, biochemical, hematology data → ML algorithm → tuning, scoring, refining → predictive toxicity model.
Multi-Modality Multi-Label Toxicity Prediction
PredTox app showing auto ML table with Model Name, Times, SMILES processed, Status, Action—highlighting tailored models.
Align AutoML Performance to Your Goals
Customizable AutoML Framework

Tailor the prediction model to your specific needs and research goals.
Reliable Prediction

Accurate prediction of multiple organ toxicity endpoints backed by model explainability and outlier detection through statistical analysis.
PredTox app showing AUC-ROC curve (accuracy) and Confusion Matrix (performance) for models, highlighting toxicity prediction.
Explain Toxicity Outcomes with Statistical Insight
Illustration of AI-powered feature extraction: central gear with 'AI', circuit lines on both sides, and 'Automated Feature Extraction' text.
AI-Powered Feature Extraction
Automated Feature Extraction

Novel feature descriptor auto extracts and refines features from the data, including user-defined and predefined features, eliminating the need for manual processing.
How PredTox
Benefits You

 
 
Efficient Screening
Streamline development by prioritizing promising compounds and avoiding potential toxicity issues early on.
Model Customization
Develop and train models tailored to your specific requirements while retaining full ownership of your pipeline IP.
Data-Driven Decisions
Make informed decisions about drug development based on reliable predictions.
Independent Analysis
Eliminate dependence on external data analysis expertise.
Adaptable Application:
Achieve flexibility and extensibility across various compounds and organ toxicities.
Scalable Learning
Future-proof scalability with federated learning support.
Secure Platform
Desktop platform for data protection, no need to share molecule information outside the organization.
Animal-Free Testing
Leverage machine learning algorithms to predict toxicities, reducing reliance on animals.

Technical Specifications

Toxicology Type

Toxicity, Adverse Effects, Carcinogenicity
Prediction Type

Binary Classification, Multiple Classification, Regression
Prediction Level

Compound, Compound + Dose, Compound + Dose + Genetic Information
Species

Multiple
Organs

Multiple
Deployment

On-Premise
Evaluation Metric

AUC, F1 Score, More
Export Results

CSV, PDF
Start evaluating potential toxicities of compounds to accelerate your drug development process today! Schedule a free demo.

FAQs


PredTox offers several advantages, including faster turnaround times, reduced animal testing, and more accurate predictions. It can help streamline your drug discovery process and accelerate time-to-market.
PredTox prioritizes data security and privacy. We do not store or retain your data. Your data is processed securely and confidentially adhering to industry-standard practices to ensure the protection of your intellectual property.
Yes, PredTox can predict both acute and chronic toxicity endpoints for a wide range of compounds. Its algorithms can analyze data to identify potential short-term and long-term toxicity, adverse effects, and carcinogenicity.
While PredTox is a powerful tool, it is important to note that no predictive model is perfect. There may be limitations in its ability to accurately predict certain types of toxicity or for compounds with unique properties. It is always recommended to use PredTox in combination with other relevant data and expert judgment.
PredTox helps reduce the reliance on animal testing, aligning with ethical considerations and regulatory pressures. PredTox contributes to a more humane and sustainable drug discovery process by minimizing animal use.
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