Reaction Details | |||
---|---|---|---|
Report a problem with these data | |||
Target | Microtubule-associated serine/threonine-protein kinase 3 | ||
Ligand | BDBM50439427 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_980178 (CHEMBL2424216) | ||
IC50 | 2400±n/a nM | ||
Citation | Li, B; Cociorva, OM; Nomanbhoy, T; Weissig, H; Li, Q; Nakamura, K; Liyanage, M; Zhang, MC; Shih, AY; Aban, A; Hu, Y; Cajica, J; Pham, L; Kozarich, JW; Shreder, KR Hit-to-lead optimization and kinase selectivity of imidazo[1,2-a]quinoxalin-4-amine derived JNK1 inhibitors. Bioorg Med Chem Lett23:5217-22 (2013) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
Microtubule-associated serine/threonine-protein kinase 3 | |||
Name: | Microtubule-associated serine/threonine-protein kinase 3 | ||
Synonyms: | KIAA0561 | MAST3 | MAST3_HUMAN | ||
Type: | PROTEIN | ||
Mol. Mass.: | 143157.77 | ||
Organism: | Homo sapiens (Human) | ||
Description: | ChEMBL_107645 | ||
Residue: | 1309 | ||
Sequence: |
| ||
BDBM50439427 | |||
n/a | |||
Name | BDBM50439427 | ||
Synonyms: | CHEMBL2420565 | ||
Type | Small organic molecule | ||
Emp. Form. | C27H31N5O2 | ||
Mol. Mass. | 457.5673 | ||
SMILES | CCC[C@@H](NC(=O)c1ccc2nc(N[C@H]3CC[C@H](O)CC3)c3nccn3c2c1)c1ccccc1 |r,wU:3.3,14.13,wD:17.17,(25.34,-27.51,;24.01,-28.28,;22.67,-27.51,;22.67,-25.97,;21.34,-25.2,;20.01,-25.97,;20.01,-27.51,;18.67,-25.2,;17.34,-25.97,;16.01,-25.2,;16.01,-23.66,;14.67,-22.89,;14.67,-21.35,;13.34,-20.58,;12.01,-21.35,;12.01,-22.89,;10.67,-23.66,;9.34,-22.89,;8,-23.66,;9.34,-21.35,;10.67,-20.58,;16.01,-20.58,;16.33,-19.08,;17.86,-18.91,;18.48,-20.32,;17.34,-21.35,;17.34,-22.89,;18.67,-23.66,;24.01,-25.2,;24.01,-23.66,;25.34,-22.89,;26.68,-23.66,;26.68,-25.2,;25.34,-25.97,)| | ||
Structure |