ProtoPRED is a computational platform allowing the easy, fast and user-friendly prediction of different properties of chemical compounds, including regulatory endpoints and others, such as:

  • Physico-chemical properties
  • Pharmacokinetics properties (ADME)
  • Human toxicity
  • Ecotoxicity

ProtoPRED uses proprietary QSAR (Quantitative Structure-Activity Relationships) models. These models are widely applied in different sectors, such as cosmetics, pharmaceutics and chemicals, to predict a broad-spectrum of properties of industrial and regulatory interest.

Our wide library of proprietary models are grouped in different modules, based on the type of property. User can select the model(s) that best match their requirements.

REACH-related endpoints

ADME endpoints

Physicochemical endpoints

Toxicological endpoints

Ecotoxicological endpoints

ProtoPRED applications are the best tools in the market, thanks to their unique set of features:

SPEED

Predictions in a few seconds/minutes, even for large sets of molecules

VERSATILITY

You can use different input formats (.xls(x), .csv, .txt, .cas, .smi, .mol and .sdf)

USER-FRIENDLY

Does not require a specific or technical knowledge to be use


REGULATORY VALIDITY

All models follow the OECD guidelines and are provided in the standard QSAR Model Reporting Format (QMRF), therefore guaranteeing their regulatory validity

BEST VALUE FOR MONEY

Save time and money with the highest level computational models in the market