Network-like similarity graphs

Wawer M, Peltason L, Weskamp N, et al. Structure-activity relationship anatomy by network-like similarity graphs and local structure-activity relationship indices. J Med Chem 2008 51 6075-6084. 

Fig. 1.16 Network-like similarity graph (NSG) depicting the CS and activity relationships of a set of lipoxygenase inhibitors taken from the work of Wawer et al. [170], Compound potencies are color coded as shown by the colored bar on the upper left hand side of the figure, red being the most active and green being the least active. Compounds are connected by an edge if the MACCS Tanimoto similarity value of a given compound pair exceeds 0.65. The decimal numbers associated with clusters of compounds correspond to SAR Index scores (See text for additional details)...

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