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. 2021 Sep 21;12(10):1546–1552. doi: 10.1021/acsmedchemlett.1c00334

Table 2. SAR Studies for Other Parts of Lead Compounds.

graphic file with name ml1c00334_0008.jpg

    biochemical inhibition IC50 (μM)a
compd R JNK3 JNK1 (R)b JNK2 (R)b p38α (R)b
18   0.002 0.258 (129) 0.029 (15) 0.024 (12)
19   0.005 1.24 (248) ndc 0.065 (13)
20   0.03 2.42 (80) 1.02 (33) 0.286 (9)
21   0.024 4.73 (197) 0.414 (17) 0.481 (20)
3   0.005 0.69 (139) ndc 0.086 (17)
22   0.002 0.26 (130) 0.074 (37) 0.057 (28)
4   0.006 0.94 (157) 0.256 (43) 0.26 (43)
23   0.002 0.213 (106) 0.052 (26) 0.106 (50)
24   0.012 0.872 (73) 0.14 (11) 0.38 (31)
25   >10 >10 ndc >10
26 2-Cl-3-F 0.169 >10 (>59) ndc 1.42 (8)
27 2-Cl-4-F 0.079 6.0 (76) ndc 0.49 (51)
28 2-Cl-5-F 1.07 >10 ndc 2.89
29 2-Cl-6-F 0.005 0.387 (77) 0.074 (15) 0.106 (21)
a

The average of ≥2 experiments with errors within 30% of the average.

b

R: ratio of IC50 values for JNK1, JNK2, and p38α over JNK3.

c

Not determined.