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. Author manuscript; available in PMC: 2016 Nov 1.
Published in final edited form as: Mol Cancer Ther. 2015 Sep 10;14(11):2497–2507. doi: 10.1158/1535-7163.MCT-15-0511

Figure 6.

Figure 6

Structural and shape comparison of identified ezrin inhibitors from MMV400 library. A) A heat map was generated based on the combined shape complementarity and chemical Tanimoto score as calculated by the OpenEye software ROCS (36). A score of 2 for a molecule represents 100% identity in shape and chemical properties. B) Overlay of all inhibitors based on the shape of NCS305787 in grey in two views rotated by 90 degrees to each other. C) Overlay of all inhibitors based on the shape of MMV020549 in grey in two views rotated by 90 degrees to each other.