Reaction Details | |||
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Target | 11-beta-hydroxysteroid dehydrogenase 1 | ||
Ligand | BDBM50445587 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_1285730 (CHEMBL3107719) | ||
IC50 | 190±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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BDBM50445587 | |||
n/a | |||
Name | BDBM50445587 | ||
Synonyms: | CHEMBL3103432 | ||
Type | Small organic molecule | ||
Emp. Form. | C23H25N5O | ||
Mol. Mass. | 387.4775 | ||
SMILES | OC1C2CC3CC1CC(C2)C3(Cc1nnn[nH]1)c1ccc(nc1)-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,(76.05,-38.4,;74.76,-39.26,;74.74,-40.79,;73.34,-41.14,;72.02,-40.65,;72.01,-39.16,;73.35,-38.68,;72.31,-39.92,;72.31,-41.5,;73.73,-42.07,;70.82,-41.93,;69.48,-41.12,;68.13,-41.88,;66.64,-41.45,;65.78,-42.73,;66.73,-43.95,;68.18,-43.41,;70.81,-43.46,;69.47,-44.22,;69.46,-45.75,;70.78,-46.53,;72.12,-45.76,;72.13,-44.23,;70.78,-48.07,;69.43,-48.84,;69.42,-50.38,;70.76,-51.16,;72.11,-50.39,;72.11,-48.85,)| | ||
Structure |