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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | 11-beta-hydroxysteroid dehydrogenase 1 | ||
| Ligand | BDBM50400176 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_878466 (CHEMBL2187380) | ||
| IC50 | 25±n/a nM | ||
| Citation |  Goldberg, FW; Leach, AG; Scott, JS; Snelson, WL; Groombridge, SD; Donald, CS; Bennett, SN; Bodin, C; Gutierrez, PM; Gyte, AC Free-Wilson and structural approaches to co-optimizing human and rodent isoform potency for 11ß-hydroxysteroid dehydrogenase type 1 (11ß-HSD1) inhibitors. J Med Chem55:10652-61 (2012) [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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| BDBM50400176 | |||
| n/a | |||
| Name | BDBM50400176 | ||
| Synonyms: | CHEMBL2179017 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C26H37N5O3 | ||
| Mol. Mass. | 467.6037 | ||
| SMILES | CC(=O)N1CC[C@H](C1)Nc1ncc(C(=O)N[C@H]2C3CC4CC2C[C@](O)(C4)C3)c(n1)C1CCCC1 |r,wU:16.16,wD:23.25,6.8,TLB:24:23:16:20.19.18,15:16:26.22.23:20.19.18,15:16:18:26.23.25,THB:24:23:16.21.20:18,25:23:16:20.19.18,25:19:16:26.22.23,22:21:18:26.23.25,22:23:16.21.20:18,(-.7,-53.39,;.83,-53.55,;1.73,-52.31,;1.45,-54.96,;.68,-56.29,;1.71,-57.44,;3.12,-56.82,;2.96,-55.28,;4.46,-57.59,;5.79,-56.82,;5.79,-55.28,;7.12,-54.5,;8.46,-55.27,;9.79,-54.49,;9.78,-52.95,;11.12,-55.26,;12.45,-54.48,;12.45,-52.74,;11.41,-51.66,;12.06,-50.39,;12.09,-51.83,;13.25,-53.16,;14.67,-52.59,;14.52,-50.97,;16.06,-50.98,;13.48,-49.85,;13.74,-52.18,;8.46,-56.82,;7.12,-57.59,;9.8,-57.59,;9.96,-59.11,;11.47,-59.43,;12.24,-58.1,;11.2,-56.95,)| | ||
| Structure | 
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