Reaction Details | |||
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Target | 11-beta-hydroxysteroid dehydrogenase 1 | ||
Ligand | BDBM50294785 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_576303 (CHEMBL1030305) | ||
IC50 | 550±n/a nM | ||
Citation | Roche, D; Carniato, D; Leriche, C; Lepifre, F; Christmann-Franck, S; Graedler, U; Charon, C; Bozec, S; Doare, L; Schmidlin, F; Lecomte, M; Valeur, E Discovery and structure-activity relationships of pentanedioic acid diamides as potent inhibitors of 11beta-hydroxysteroid dehydrogenase type I. Bioorg Med Chem Lett19:2674-8 (2009) [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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BDBM50294785 | |||
n/a | |||
Name | BDBM50294785 | ||
Synonyms: | 3,3-Dimethyl-pentanedioic acid cyclopropylamide(5-hydroxy-adamantan-2-yl)-amide | CHEMBL552519 | ||
Type | Small organic molecule | ||
Emp. Form. | C20H32N2O3 | ||
Mol. Mass. | 348.4797 | ||
SMILES | CC(C)(CC(=O)NC1CC1)CC(=O)N[C@H]1C2CC3CC1C[C@@](O)(C3)C2 |r,wU:14.14,21.23,TLB:18:17:24:20.19.14,18:19:23.17.16:24,14:15:23:20.18.19,THB:14:19:23:16.15.24,13:14:23.17.16:24,(-.41,-18.77,;.69,-17.68,;1.77,-18.77,;2.03,-16.92,;3.36,-17.69,;3.35,-19.23,;4.69,-16.93,;6.02,-17.71,;6.79,-19.04,;7.57,-17.71,;-.64,-16.91,;-1.98,-17.67,;-1.99,-19.21,;-3.31,-16.89,;-4.58,-17.77,;-4.56,-19.27,;-6.09,-19.78,;-7.57,-19.19,;-7.56,-17.68,;-6,-17.21,;-6.84,-18.38,;-6.88,-19.79,;-6.89,-21.33,;-8.51,-20.43,;-5.5,-20.35,)| | ||
Structure |