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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | 11-beta-hydroxysteroid dehydrogenase 1 | ||
| Ligand | BDBM50448698 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_1297897 (CHEMBL3132110) | ||
| IC50 | 9.0±n/a nM | ||
| Citation |  Goldberg, FW; Dossetter, AG; Scott, JS; Robb, GR; Boyd, S; Groombridge, SD; Kemmitt, PD; Sjögren, T; Gutierrez, PM; deSchoolmeester, J; Swales, JG; Turnbull, AV; Wild, MJ Optimization of brain penetrant 11ß-hydroxysteroid dehydrogenase type I inhibitors and in vivo testing in diet-induced obese mice. J Med Chem57:970-86 (2014) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| 11-beta-hydroxysteroid dehydrogenase 1 | |||
| Name: | 11-beta-hydroxysteroid dehydrogenase 1 | ||
| Synonyms: | 11-DH | 11-beta-HSD1 | 11-beta-Hydroxysteroid Dehydrogenase 1 (11-beta-HSD1) | 11-beta-hydroxysteroid dehydrogenase | 11-beta-hydroxysteroid dehydrogenase 1 (11HSD1) | Corticosteroid 11-beta-dehydrogenase isozyme 1 | Corticosteroid 11-beta-dehydrogenase isozyme 1 (11-beta-HSD-1) | Corticosteroid 11-beta-dehydrogenase isozyme 1 (11-beta-HSD1) | Corticosteroid 11-beta-dehydrogenase isozyme 1 (11beta-HSD1) | DHI1_HUMAN | HSD11 | HSD11B1 | HSD11L | SDR26C1 | ||
| Type: | Enzyme | ||
| Mol. Mass.: | 32409.16 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P28845 | ||
| Residue: | 292 | ||
| Sequence: |
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| BDBM50448698 | |||
| n/a | |||
| Name | BDBM50448698 | ||
| Synonyms: | CHEMBL3127864 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C21H30N2O4S | ||
| Mol. Mass. | 406.539 | ||
| SMILES | COC[C@@H](C)Oc1nc(C2CC2)c(s1)C(=O)N[C@H]1C2CC3CC1C[C@](O)(C3)C2 |r,wU:24.27,wD:17.18,3.3,TLB:16:17:21:23.24.26,27:24:17.18.19:21,THB:27:18:21:23.24.26,26:24:17:19.20.21,26:20:17:23.27.24,25:24:17:19.20.21,25:24:17.18.19:21,(42.84,-7.77,;44.29,-8.27,;45.45,-7.25,;46.91,-7.75,;47.21,-9.27,;48.07,-6.74,;49.53,-7.24,;49.98,-8.71,;51.52,-8.74,;52.41,-9.99,;52.55,-11.53,;53.81,-10.64,;52.02,-7.28,;50.79,-6.36,;53.35,-6.51,;53.34,-4.97,;54.69,-7.27,;56.02,-6.5,;57.52,-6.11,;57.54,-4.52,;58.6,-3.3,;57.25,-3.75,;57.23,-5.25,;58.55,-5.76,;59.96,-5.44,;61.5,-5.4,;60,-3.91,;58.92,-6.7,)| | ||
| Structure | 
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