| FLT3 | FMS-like tyrosine kinase-3 |
| AML | acute myeloid leukemia |
| MM-PB(GB)SA | Molecular Mechanics Poison–Boltzmann/Generalized Born Surface Area |
| LIE | linear interaction energy |
| BE | binding Energy |
| CoMFA | comparative molecular field analysis |
| CoMSIA | comparative molecular similarity indices analysis |
| 3D-QSAR | three-dimensional structure–activity relationship |