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  • SwissTargetPrediction
    Target prediction has been submitted Calculations can take up to one minute Please be patient
  • SwissTargetPrediction
    About This website allows you to estimate the most probable macromolecular targets of a small molecule, assumed as bioactive The prediction is founded on a combination of 2D and 3D similarity with a library of 37 0'000 known actives on more than 3000 proteins from three different species The webtool is described in detail here: SwissTargetPrediction: updated data and new features for
  • SwissTargetPrediction
    Predicted Targets Page This is the main result page The chemical structure of the query molecule is displayed in a first box together with interoperability icons allowing to submit the molecule to other in house web tools A dynamic table ranks the predicted targets for the query molecule The table can be sorted according to any column (by clicking the corresponding header), extended by
  • SwissTargetPrediction
    SwissDock SwissParam
  • SwissTargetPrediction
    We hope SwissTargetPrediction has been useful for your research If so, please cite the following articles: The main article describing the web service and its underlying methodologies is: Daina, A , Michielin, O , and Zoete, V (2019) SwissTargetPrediction: updated data and new features for efficient prediction of protein targets of small molecules Nucl Acids Res 47 (W1), W357-W364 For a
  • SwissTargetPrediction
    This Web tool is operated by the Molecular Modelling Group of the University of Lausanne and the SIB Swiss Institute of Bioinformatics | Terms of use | SIB privacy policy
  • SwissTargetPrediction
    Input Page The input page allows you to submit a query molecule either by writing pasting the SMILES in the input text box, or by using the molecular sketcher on the right for drawing importing any molecular structure The content of the text box and the sketcher are synchronized You have the possibility to load examples as shown in the image below You can also select the species of protein
  • SwissTargetPrediction
    Download datasets used in SwissTargetPrediction Validation dataset 2019 List of SMILES List of interactions Validation dataset used in Gfeller et al , NAR 2014 List of SMILES List of interactions Homology-based prediction validation Homology relationships List of homology relationships Homology full validation Full list of interactions used to validate the homology-based predictions
  • SwissTargetPrediction
    Known Actives Page This page displays the compounds, which have driven the prediction for a given protein as target of the query molecule These compouds are experimentally defined as actives on the target under investigation (here, the subunits alpha4 and beta2 of the neuronal acetylcholine receptor) and highly similar to your query molecule based on 2D (in this example) or on 3D simlarity
  • SwissTargetPrediction
    We hope SwissTargetPrediction has been useful for your research Should you have any question or feedback, please fill out the form below and send it to us





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