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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | 11-beta-hydroxysteroid dehydrogenase 1 | ||
| Ligand | BDBM50400141 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_878466 (CHEMBL2187380) | ||
| IC50 | 53±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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| BDBM50400141 | |||
| n/a | |||
| Name | BDBM50400141 | ||
| Synonyms: | CHEMBL2179447 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C23H32N4O3 | ||
| Mol. Mass. | 412.5252 | ||
| SMILES | O[C@@]12CC3CC(C1)[C@H](NC(=O)c1cnc(NC4CCOCC4)nc1C1CC1)C(C3)C2 |r,wU:7.8,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,(62.22,-3.09,;60.68,-3.08,;59.64,-1.96,;58.23,-2.5,;57.57,-3.78,;58.61,-4.85,;59.91,-4.3,;58.62,-6.6,;57.28,-7.37,;55.95,-6.61,;55.94,-5.07,;54.62,-7.38,;53.28,-6.62,;51.95,-7.39,;51.95,-8.93,;50.62,-9.7,;49.28,-8.93,;49.29,-7.38,;47.97,-6.61,;46.63,-7.37,;46.62,-8.92,;47.96,-9.7,;53.28,-9.7,;54.62,-8.93,;55.96,-9.7,;56.73,-11.04,;57.5,-9.7,;59.41,-5.27,;58.25,-3.95,;60.83,-4.71,)| | ||
| Structure | 
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