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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | 11-beta-hydroxysteroid dehydrogenase 1 | ||
| Ligand | BDBM50400172 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_878466 (CHEMBL2187380) | ||
| IC50 | 27±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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| BDBM50400172 | |||
| n/a | |||
| Name | BDBM50400172 | ||
| Synonyms: | CHEMBL2179021 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C25H35N5O3 | ||
| Mol. Mass. | 453.5771 | ||
| SMILES | O[C@@]12CC3CC(C1)[C@H](NC(=O)c1cnc(N[C@@H]4CCC(=O)NC4)nc1C1CCCC1)C(C3)C2 |r,wU:7.8,wD:1.0,16.16,TLB:0:1:7:31.3.4,8:7:6.32.1:31.3.4,8:7:4:6.1.2,THB:0:1:7.30.31:4,2:1:7:31.3.4,2:3:7:6.32.1,32:30:4:6.1.2,32:1:7.30.31:4,(18.58,-4.69,;17.05,-4.67,;16.01,-3.55,;14.59,-4.1,;13.94,-5.37,;14.97,-6.45,;16.27,-5.89,;14.98,-8.19,;13.65,-8.97,;12.31,-8.2,;12.31,-6.66,;10.98,-8.98,;9.65,-8.21,;8.32,-8.98,;8.32,-10.53,;6.98,-11.3,;5.65,-10.53,;4.31,-11.29,;2.98,-10.51,;2.99,-8.97,;1.66,-8.19,;4.32,-8.21,;5.65,-8.98,;9.65,-11.3,;10.99,-10.53,;12.32,-11.29,;12.49,-12.82,;14,-13.14,;14.76,-11.8,;13.73,-10.66,;15.78,-6.86,;14.61,-5.54,;17.19,-6.3,)| | ||
| Structure | 
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