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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | 11-beta-hydroxysteroid dehydrogenase 1 | ||
| Ligand | BDBM50400137 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_878466 (CHEMBL2187380) | ||
| IC50 | 31±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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| BDBM50400137 | |||
| n/a | |||
| Name | BDBM50400137 | ||
| Synonyms: | CHEMBL2179451 | ||
| 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:7.8,16.16,wD:1.0,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,(54.3,-14.56,;52.77,-14.55,;51.72,-13.43,;50.3,-13.97,;49.66,-15.24,;50.68,-16.32,;51.99,-15.77,;50.69,-18.07,;49.37,-18.85,;48.03,-18.08,;48.02,-16.54,;46.7,-18.86,;45.36,-18.09,;44.03,-18.86,;44.03,-20.41,;42.69,-21.17,;41.35,-20.41,;39.94,-21.03,;38.92,-19.89,;39.69,-18.55,;41.19,-18.88,;45.36,-21.18,;46.7,-20.41,;48.04,-21.17,;48.43,-22.66,;49.92,-22.26,;49.52,-20.77,;51.5,-16.74,;50.33,-15.41,;52.91,-16.18,)| | ||
| Structure | 
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