Reaction Details | |||
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Target | 11-beta-hydroxysteroid dehydrogenase 1 | ||
Ligand | BDBM50112134 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_1512869 (CHEMBL3611791) | ||
IC50 | 28±n/a nM | ||
Citation | Hong, SP; Nam, KY; Shin, YJ; Kim, KW; Ahn, SK Discovery of 11ß-hydroxysteroid dehydrogenase type 1 inhibitor. Bioorg Med Chem Lett25:3501-6 (2015) [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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BDBM50112134 | |||
n/a | |||
Name | BDBM50112134 | ||
Synonyms: | CHEMBL3609862 | ||
Type | Small organic molecule | ||
Emp. Form. | C17H21FN2O3S | ||
Mol. Mass. | 352.424 | ||
SMILES | NC(=O)C12CC3CC(C1)[C@H](NS(=O)(=O)c1ccccc1F)C(C3)C2 |r,wD:9.10,TLB:8:3:22:6.7.9,10:9:22:23.4.3,THB:4:5:9:23.3.8,4:3:22.5.6:9,8:7:22:23.4.3,1:3:22:6.7.9,1:3:22.5.6:9,(3.58,2.29,;3.07,1.17,;3.79,.17,;1.56,1.02,;1.56,2.59,;.12,3.07,;-1,2.05,;-.95,.32,;.56,-.22,;-2.19,-.22,;-3.39,-1.17,;-4.82,-.59,;-4.99,.63,;-3.85,.17,;-6.03,-1.55,;-5.81,-3.07,;-7.02,-4.02,;-8.45,-3.45,;-8.67,-1.93,;-7.46,-.97,;-7.63,.25,;-1.2,1.02,;-1.2,2.69,;.34,.44,)| | ||
Structure |