Reaction Details | |||
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Target | 11-beta-hydroxysteroid dehydrogenase 1 | ||
Ligand | BDBM50195489 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_425005 (CHEMBL912530) | ||
Ki | 5.2±n/a nM | ||
Citation | Richards, S; Sorensen, B; Jae, HS; Winn, M; Chen, Y; Wang, J; Fung, S; Monzon, K; Frevert, EU; Jacobson, P; Sham, H; Link, JT Discovery of potent and selective inhibitors of 11beta-HSD1 for the treatment of metabolic syndrome. Bioorg Med Chem Lett16:6241-5 (2006) [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 1 | Corticosteroid 11-beta-dehydrogenase isozyme 1 | Corticosteroid 11-beta-dehydrogenase isozyme 1 (11-beta-HSD-1) | DHI1_RAT | Hsd11 | Hsd11b1 | ||
Type: | Enzyme | ||
Mol. Mass.: | 31889.48 | ||
Organism: | Rattus norvegicus (rat) | ||
Description: | P16232 | ||
Residue: | 288 | ||
Sequence: |
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BDBM50195489 | |||
n/a | |||
Name | BDBM50195489 | ||
Synonyms: | 4-amino-3,5-dichloro-N-cyclopropyl-N-((1s,4s)-4-(pyrrolidine-1-carbonyl)cyclohexyl)benzamide | CHEMBL222256 | ||
Type | Small organic molecule | ||
Emp. Form. | C21H27Cl2N3O2 | ||
Mol. Mass. | 424.364 | ||
SMILES | Nc1c(Cl)cc(cc1Cl)C(=O)N(C1CC1)[C@H]1CC[C@H](CC1)C(=O)N1CCCC1 |wU:15.16,18.23,(.96,-40.89,;-.37,-40.12,;-.38,-38.57,;.95,-37.8,;-1.71,-37.81,;-3.04,-38.58,;-3.05,-40.12,;-1.71,-40.89,;-1.71,-42.43,;-4.38,-37.81,;-4.38,-36.27,;-5.71,-38.58,;-7.04,-37.81,;-7.81,-36.47,;-8.58,-37.81,;-5.71,-40.12,;-4.38,-40.89,;-4.38,-42.43,;-5.72,-43.2,;-7.05,-42.42,;-7.05,-40.89,;-5.72,-44.74,;-7.06,-45.5,;-4.39,-45.51,;-4.23,-47.05,;-2.73,-47.38,;-1.95,-46.05,;-2.98,-44.9,)| | ||
Structure |