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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | 11-beta-hydroxysteroid dehydrogenase 1 | ||
| Ligand | BDBM50334674 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_699055 (CHEMBL1646336) | ||
| IC50 | 20±n/a nM | ||
| Citation |  Sun, D; Wang, Z; Caille, S; DeGraffenreid, M; Gonzalez-Lopez de Turiso, F; Hungate, R; Jaen, JC; Jiang, B; Julian, LD; Kelly, R; McMinn, DL; Kaizerman, J; Rew, Y; Sudom, A; Tu, H; Ursu, S; Walker, N; Willcockson, M; Yan, X; Ye, Q; Powers, JP Synthesis and optimization of novel 4,4-disubstituted cyclohexylbenzamide derivatives as potent 11ß-HSD1 inhibitors. Bioorg Med Chem Lett21:405-10 (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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| BDBM50334674 | |||
| n/a | |||
| Name | BDBM50334674 | ||
| Synonyms: | CHEMBL1642594 | N-cyclopropyl-N-((4R)-4-(methylsulfonamidomethyl)-4-phenylcyclohexyl)-4-((S)-1,1,1-trifluoro-2-hydroxypropan-2-yl)benzamide | ||
| Type | Small organic molecule | ||
| Emp. Form. | C27H33F3N2O4S | ||
| Mol. Mass. | 538.622 | ||
| SMILES | C[C@](O)(c1ccc(cc1)C(=O)N(C1CC1)[C@H]1CC[C@@](CNS(C)(=O)=O)(CC1)c1ccccc1)C(F)(F)F |r,wU:1.0,15.16,wD:1.1,18.29,(25.62,-10.27,;26.95,-9.49,;25.46,-9.1,;28.29,-10.25,;29.62,-9.48,;30.96,-10.25,;30.96,-11.79,;29.64,-12.56,;28.3,-11.8,;32.29,-12.55,;32.3,-14.09,;33.63,-11.78,;33.62,-10.24,;34.39,-8.91,;32.85,-8.91,;34.96,-12.55,;36.3,-11.77,;37.63,-12.55,;37.63,-14.09,;38.95,-13.31,;40.29,-14.07,;41.62,-13.29,;42.96,-14.05,;40.84,-11.95,;42.53,-12.04,;36.3,-14.85,;34.96,-14.09,;38.38,-15.42,;37.6,-16.74,;38.36,-18.07,;39.89,-18.08,;40.67,-16.75,;39.91,-15.42,;26.94,-7.95,;28.28,-7.17,;25.6,-7.18,;26.54,-6.46,)| | ||
| Structure | 
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