Reaction Details | |||
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Target | 11-beta-hydroxysteroid dehydrogenase 1 | ||
Ligand | BDBM50334706 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_699259 (CHEMBL1647079) | ||
IC50 | 8±n/a nM | ||
Citation | Kwon, SW; Kang, SK; Lee, JH; Bok, JH; Kim, CH; Dal Rhee, S; Jung, WH; Kim, HY; Bae, MA; Song, JS; Ha, DC; Cheon, HG; Kim, KY; Ahn, JH Synthesis and 11ß hydroxysteroid dehydrogenase 1 inhibition of thiazolidine derivatives with an adamantyl group. Bioorg Med Chem Lett21:435-9 (2010) [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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BDBM50334706 | |||
n/a | |||
Name | BDBM50334706 | ||
Synonyms: | 3-(Toluene-4-sulfonyl)-thiazolidine-2-carboxylic acid(5-carbamoyl-adamantan-2-yl)-amide | CHEMBL1642620 | ||
Type | Small organic molecule | ||
Emp. Form. | C22H29N3O4S2 | ||
Mol. Mass. | 463.613 | ||
SMILES | Cc1ccc(cc1)S(=O)(=O)N1CCSC1C(=O)NC1C2CC3CC1CC(C3)(C2)C(N)=O |TLB:17:18:24.27.25:20.21.22,17:18:22:24.25.26,27:25:18.19.20:22,THB:27:19:22:24.25.26,26:25:18:20.21.22,26:21:18:24.27.25,28:25:18:20.21.22,28:25:18.19.20:22,(21.54,-45.78,;22.86,-44.98,;22.84,-43.44,;24.16,-42.65,;25.5,-43.41,;25.53,-44.94,;24.21,-45.73,;26.82,-42.62,;26.04,-41.28,;27.58,-41.28,;28.17,-43.37,;28.64,-44.83,;30.18,-44.83,;30.66,-43.37,;29.41,-42.46,;29.41,-40.92,;28.07,-40.15,;30.74,-40.15,;32.07,-40.91,;33.57,-40.49,;33.57,-38.91,;34.61,-37.68,;33.26,-38.15,;33.27,-39.64,;34.6,-40.13,;35.99,-39.78,;36,-38.25,;34.98,-41.06,;37.53,-39.72,;38.35,-41.02,;38.25,-38.36,)| | ||
Structure |