Reaction Details | |||
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Target | 11-beta-hydroxysteroid dehydrogenase 1 | ||
Ligand | BDBM50317214 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_631347 (CHEMBL1105684) | ||
IC50 | 0.03±n/a nM | ||
Citation | Cheng, H; Hoffman, J; Le, P; Nair, SK; Cripps, S; Matthews, J; Smith, C; Yang, M; Kupchinsky, S; Dress, K; Edwards, M; Cole, B; Walters, E; Loh, C; Ermolieff, J; Fanjul, A; Bhat, GB; Herrera, J; Pauly, T; Hosea, N; Paderes, G; Rejto, P The development and SAR of pyrrolidine carboxamide 11beta-HSD1 inhibitors. Bioorg Med Chem Lett20:2897-902 (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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BDBM50317214 | |||
n/a | |||
Name | BDBM50317214 | ||
Synonyms: | (2R)-N-(adamantan-2-yl)-1-(2-methylpropyl)pyrrolidine-2-carboxamide | CHEMBL1098130 | ||
Type | Small organic molecule | ||
Emp. Form. | C19H32N2O | ||
Mol. Mass. | 304.4702 | ||
SMILES | CC(C)CN1CCC[C@@H]1C(=O)NC1C2CC3CC(C2)CC1C3 |r,wU:8.9,TLB:18:17:21:14.13.12,18:13:16.17.19:21,THB:11:12:16.17.19:21,12:13:16:19.20.21,12:20:16:14.18.13,(-4.2,-19.79,;-5.1,-21.04,;-6.63,-20.89,;-4.46,-22.45,;-5.36,-23.69,;-6.89,-23.71,;-7.36,-25.17,;-6.12,-26.07,;-4.91,-25.1,;-3.4,-25.61,;-2.05,-24.86,;-3.42,-27.15,;-4.77,-27.89,;-4.78,-29.42,;-6.18,-29.78,;-7.52,-29.28,;-8.71,-30.56,;-7.21,-30.14,;-5.8,-30.71,;-7.22,-28.56,;-6.17,-27.31,;-7.53,-27.8,)| | ||
Structure |