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HitPick

Hit Identification & Target Prediction

HitPick is a web server that facilitates the analysis of chemical screenings by identifying hits and predicting their molecular targets. The target prediction functionality can also be used in a stand-alone fashion.

For hit identification, the widely used B-score method is applied.

For target prediction, HitPick applies a new approach that combines two 2D molecular similarity based methods, namely, simple 1-Nearest-Neighbour (1NN) similarity searching and a machine learning method based on Laplacian-modified naive Bayesian models.


References

This product was mentioned in articles:

36 Web Resources For Target Hunting In Drug Discovery - Nov. 22, 2017
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