Reaction Details | |||
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Target | 11-beta-hydroxysteroid dehydrogenase 1 | ||
Ligand | BDBM50445584 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_1285730 (CHEMBL3107719) | ||
IC50 | 640±n/a nM | ||
Citation | Ye, XY; Yoon, D; Chen, SY; Nayeem, A; Golla, R; Seethala, R; Wang, M; Harper, T; Sleczka, BG; Apedo, A; Li, YX; He, B; Kirby, M; Gordon, DA; Robl, JA Synthesis and structure-activity relationship of 2-adamantylmethyl tetrazoles as potent and selective inhibitors of human 11ß-hydroxysteroid dehydrogenase type 1 (11ß-HSD1). Bioorg Med Chem Lett24:654-60 (2014) [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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BDBM50445584 | |||
n/a | |||
Name | BDBM50445584 | ||
Synonyms: | CHEMBL3103306 | ||
Type | Small organic molecule | ||
Emp. Form. | C24H26N4O | ||
Mol. Mass. | 386.4894 | ||
SMILES | OC1C2CC3CC1CC(C2)C3(Cc1nnn[nH]1)c1cccc(c1)-c1ccccc1 |TLB:0:1:10.8.7:5,9:8:5:3.2.1,1:2:10:7.6.5,1:6:10:3.9.2,17:10:5:3.2.1,11:10:3.9.2:7.6.5,THB:9:2:10.8.7:5,17:10:3.9.2:7.6.5,11:10:5:3.2.1,(56.75,-15.02,;55.46,-15.88,;55.44,-17.41,;54.04,-17.76,;52.72,-17.26,;52.71,-15.78,;54.05,-15.29,;53.01,-16.53,;53.02,-18.12,;54.43,-18.69,;51.52,-18.54,;50.18,-17.74,;48.83,-18.49,;47.34,-18.07,;46.48,-19.35,;47.43,-20.57,;48.88,-20.03,;51.51,-20.08,;50.17,-20.84,;50.16,-22.37,;51.48,-23.15,;52.82,-22.38,;52.83,-20.85,;54.16,-23.16,;54.15,-24.7,;55.48,-25.48,;56.83,-24.71,;56.83,-23.16,;55.49,-22.39,)| | ||
Structure |