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Table 6 Predicted values and calculated h of pIC50 (µM) according to different methods

From: QSAR studies on PIM1 and PIM2 inhibitors using statistical methods: a rustic strategy to screen for 5-(1H-indol-5-yl)-1,3,4-thiadiazol analogues and predict their PIM inhibitory activity

Compound Molecular structure Pubchem CID Pred (PIC50) for PIM1 h Pred (PIC50) for PIM2 h
1 68328588 7.782 0.122 7.455 0.213
2 45377352 10.367 0.906 9.497 1.117
3 68328129 7.316 0.352 7.243 0.162
4 68327929 8.332 0.102 7.513 0.330
5 68328158 8.311 0.074 7.072 1.109
6 68328259 8.434 0.113 7.958 0.106
7 68328426 8.347 0.089 8.026 0.151
8 68328539 8.137 0.387 6.699 0.111
9 68328547 8.282 0.1023 7.594 0.0964
10 68328676 8.138 0.0739 7.068 0.7669
11 68328891 8.329 0.0860 8.244 0.2909
12 68356801 8.745 0.2543 8.137 0.9468