A new powerful platform that delivers reliable in silico predictors for physicochemical properties, ADME characteristics, and toxicity endpoints in one seamless environment.

Leveraging the expertise and strengths of two in silico prediction leaders, the merger between ACD/Labs and Pharma Algorithms in 2009, brings together complementary tools to facilitate chemistry workflow challenges presented in various applications including drug discovery and development, REACH, regulatory submissions, ecotoxicity studies, and compound safety assessments.

Whether you are an expert working in isolation or seeking an organization-wide implementation, ACD/Percepta is available as a flexible desktop or enterprise solution.

ACD/Percepta Profilers ACD/Percepta Structure Design ACD/Percepta Predictors

Three Flexible and Powerful Prediction Components

Profilers

Screen and Profile Compounds
Quickly prioritize compounds using physicochemical, ADME, and toxicity predictions. Selecting compounds of interest has never been easier with colour-coded indications that rank predictions according to user-defined thresholds for specific criteria.
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Structure Design

Optimize Lead Compounds
Interactively optimize lead compounds using specialized structure-based tools to adjust molecular properties by PhysChem, ADME, and toxicity parameters. Easily add or modify substituents of scaffold structures to improve permeability, adjust pKa or reduce potential toxic liabilities. Focus design efforts on safe and efficacious drugs, avoiding harmful ones early.
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Predictors

Evaluate Structure-Property Relationships
Advanced prediction tools give users the ability to interactively adjust parameters for given properties and interpret quantitative predictions with probability values, reliability indexes, and similar structures. Determine structural contributions with color-coded atoms and substructure highlighting. Improve prediction accuracy by training the models with experimental data.
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Company-Wide Access to Property Predictions

Deliver enterprise-level access to in silico predictions via simple desktop installations or thin-client access to web services. Easy-to-configure desktop installations ensure uniform execution of project deliverables. Scalable options include a thin client intranet application that provides users with quick access to property predictions, without the need to manage software on individual computers.

ACD/Percepta offers unique value to organizations in the ability to design, screen, and evaluate compounds based on structure-property relationships, all within a single integrated interface, using PhysChem, ADME, and toxicity predictions.

For more information or to request a demo, contact us.