Table 6.
Inhibition constant result of standard ligand docking simulation and modification towards HDAC Class II.
| Ligand | Inhibition constant, Ki (nM) | |||||
|---|---|---|---|---|---|---|
| HDAC 4 | HDAC 5 | HDAC 6 | HDAC 7 | HDAC 9 | HDAC 10 | |
| SAHA | 5160 | 7940 | 5350 | 6400 | 17600 | 8100 |
| 1a | 500 | 1620 | 2430 | 1880 | 1800 | 210 |
| 1b | 1200 | 5350 | 7310 | 1690 | 4560 | 1260 |
| 1c | 1900 | 2360 | 7540 | 610 | 920 | 120 |
| 1d | 1660 | 2920 | 63110 | 1930 | 3140 | 590 |
| 1e | 3360 | 3150 | 2820 | 2560 | 1740 | 890 |
| 1f | 230 | 290 | 1150 | 200 | 3390 | 660 |
| 2a | 360 | 90 | 710 | 220 | 1250 | 810 |
| 2b | 130 | 80 | 2760 | 390 | 5300 | 1270 |
| 2c | 120 | 310 | 70 | 170 | 940 | 1500 |
| 2d | 400 | 180 | 940 | 160 | 1680 | 670 |
| 2e | 430 | 630 | 1030 | 440 | 22380 | 1100 |
| 2f | 240 | 50 | 590 | 160 | 1730 | 970 |
* Numbers in bold are the lowest amount of inhibition constant value.