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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | 11-beta-hydroxysteroid dehydrogenase 1 | ||
| Ligand | BDBM50400138 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_878466 (CHEMBL2187380) | ||
| IC50 | 23±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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| BDBM50400138 | |||
| n/a | |||
| Name | BDBM50400138 | ||
| Synonyms: | CHEMBL2179450 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C23H32N4O3 | ||
| Mol. Mass. | 412.5252 | ||
| SMILES | O[C@@]12CC3CC(C1)[C@H](NC(=O)c1cnc(N[C@@H]4CCOC4)nc1C1CCC1)C(C3)C2 |r,wU:7.8,wD:1.0,16.16,TLB:0:1:7:28.3.4,8:7:6.29.1:28.3.4,8:7:4:6.1.2,THB:0:1:7.27.28:4,2:1:7:28.3.4,2:3:7:6.29.1,29:27:4:6.1.2,29:1:7.27.28:4,(34.67,-14.85,;33.13,-14.84,;32.09,-13.72,;30.67,-14.26,;30.02,-15.53,;31.05,-16.61,;32.35,-16.06,;31.06,-18.35,;29.73,-19.14,;28.39,-18.37,;28.39,-16.82,;27.06,-19.15,;25.72,-18.38,;24.39,-19.15,;24.39,-20.7,;23.05,-21.46,;21.72,-20.7,;20.31,-21.32,;19.28,-20.17,;20.05,-18.84,;21.56,-19.17,;25.73,-21.46,;27.07,-20.7,;28.4,-21.46,;28.8,-22.95,;30.29,-22.55,;29.89,-21.06,;31.86,-17.03,;30.69,-15.7,;33.28,-16.47,)| | ||
| Structure | 
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