Reaction Details | |||
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Target | 11-beta-hydroxysteroid dehydrogenase 1 | ||
Ligand | BDBM50193794 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_424101 (CHEMBL856747) | ||
IC50 | 832±n/a nM | ||
Citation | Yeh, VS; Kurukulasuriya, R; Fung, S; Monzon, K; Chiou, W; Wang, J; Stolarik, D; Imade, H; Shapiro, R; Knourek-Segel, V; Bush, E; Wilcox, D; Nguyen, PT; Brune, M; Jacobson, P; Link, JT Discovery of orally active butyrolactam 11beta-HSD1 inhibitors. Bioorg Med Chem Lett16:5555-60 (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 | 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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BDBM50193794 | |||
n/a | |||
Name | BDBM50193794 | ||
Synonyms: | 3-benzyl-1-(5-hydroxy-adamantan-2-yl)-pyrrolidin-2-one | CHEMBL376306 | ||
Type | Small organic molecule | ||
Emp. Form. | C21H27NO2 | ||
Mol. Mass. | 325.4446 | ||
SMILES | O[C@@]12CC3CC(C1)[C@@H](C(C3)C2)N1CCC(Cc2ccccc2)C1=O |wU:7.13,wD:1.0,TLB:4:3:10:6.5.7,4:5:2.3.9:10,THB:7:5:2:9.8.10,7:8:2:6.4.5,11:7:2.3.9:10,(16.16,6.86,;16.17,5.31,;14.75,5.95,;15.69,4.73,;15.75,3.19,;17.28,2.6,;16.29,3.78,;18.6,3.19,;18.6,4.72,;17.14,5.26,;17.61,5.91,;19.93,2.42,;20.46,.99,;22,1.05,;22.42,2.51,;23.78,3.21,;25.07,2.37,;24.99,.83,;26.28,-0,;27.66,.72,;27.74,2.23,;26.44,3.08,;21.13,3.38,;21.13,4.99,)| | ||
Structure |