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Anne M. Wassermann, Dilyana Dimova and Jürgen Bajorath Comprehensive Analysis of Single- and Multi-Target Activity Cliffs Formed by Currently Available Bioactive Compounds Chemical Biology & Drug Design 78

Article first published online: 24 JUN 2011 | DOI: 10.1111/j.1747-0285.2011.01150.x

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A systematic analysis of single- and multi-target activity cliffs contained in currently available collections of bioactive compounds is reported. The distribution of large-magnitude activity cliffs over different target families, the target selectivity of cliff-forming compounds, and the polypharmacological nature of multi-target activity cliffs was studied.

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