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

Table 7 Observed values and calculated values of pIC₅₀ according to different methods

No	pIC₅₀ (obs)	pIC₅₀ PIM1 (pred)	pIC₅₀ PIM2 (pred)
No	pIC₅₀ (obs)	MLR	MLR
1^a	5.567	6.781	6.161
2^b	5.996	6.769	5.581
3	5.787	6.744	4.604
4	4.657	5.440	6.154
5^a	6.458	6.495	7.250
6^b	6.010	6.708	7.455
7	6.983	7.793	6.373
8^a	7.229	7.967	7.388
9^{a, b}	7.431	7.791	7.708
10	7.677	7.781	7.446
11^b	6.644	7.996	8.308
12	6.717	6.622	7.265
13	7.376	7.870	7.252
14	7.920	8.049	7.379
15	8.000	7.844	7.016
16	8.221	8.398	7.487
17	7.744	8.148	7.039
18	7.657	7.638	7.186
19	8.000	8.000	7.334
20	7.387	7.756	6.475
21	6.943	7.965	7.206
22^b	7.552	7.689	8.003
23^{a, b}	7.769	8.524	8.223
24^a	7.602	8.408	5.947
25	5.889	7.578	7.268

ISSN: 2661-801X