FIGURE 3.

Many ‘drug-like’ molecules form promiscuous aggregates at micromolar concentrations. More than 1000 such compounds were evaluated for detergent-dependent inhibition and dynamic light-scattering, using 96-well plate based assays. Molecules were tested in different sets: two sets of predicted aggregators and two sets of predicted non-aggregators, derived using different computational models, were tested, as was a fifth category chosen at random from a ‘drug-like’ subset of the ChemDiv collection (see text). Reprinted, with permission, from Ref. [17].