Percepta

Percepta is a comprehensive platform designed to predict and manage molecular property data, including physicochemical and ADME/Tox properties. It offers a suite of applications that allow users to predict molecular properties from chemical structures and train models using experimental data. Users can integrate custom models developed in-house to ensure that property calculations are based on the most current information.

This platform is ideal for organizations aiming to discover and optimize novel compounds with specific drug-like properties, reduce R&D costs by evaluating compound behavior before synthesis, and manage in silico molecular property data centrally. It supports high-throughput screening and can be used as an alternative to experimental data in regulatory submissions.

The Percepta Difference

Percepta's models and algorithms are industry-leading, having been used by major pharmaceutical and environmental researchers for over 25 years. The platform's calculation models are based on curated experimental data, ensuring fast, accurate, and reliable results. Users can assess the reliability of results through calculation protocols, reliability indices, and references to similar structures and literature.

The software is user-friendly, allowing users to draw or import structures to calculate properties easily. Model training does not require expertise in computational chemistry or programming. The platform also provides insights from data, enabling users to visualize substructure contributions to property values and identify trends to prioritize compounds.

Key Features

• Trainable algorithms that enhance prediction accuracy using in-house experimental data.
• Expandable to include third-party models and consolidate existing property calculators.
• Flexible deployment options, including installation on individual computers or as a browser-based application, with batch deployment for high-throughput screening.
• Integration with workflow tools like Pipeline Pilot and KNIME for streamlined processes.

Percepta offers predictive modules for various properties, including physicochemical (e.g., aqueous solubility, boiling point), ADME (e.g., blood-brain barrier permeation, oral bioavailability), and toxicity (e.g., acute toxicity, mutagenicity). The platform is widely adopted, with over 80% of the world's top 25 pharma companies and more than 1100 companies and institutions globally choosing Percepta for molecular profiling and property prediction.