Reaction Details | |||
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Target | 11-beta-hydroxysteroid dehydrogenase 1 | ||
Ligand | BDBM50317220 | ||
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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BDBM50317220 | |||
n/a | |||
Name | BDBM50317220 | ||
Synonyms: | (2R)-N-(adamantan-2-yl)-1-[(4-cyanophenyl)methyl]pyrrolidine-2-carboxamide | CHEMBL1098145 | ||
Type | Small organic molecule | ||
Emp. Form. | C23H29N3O | ||
Mol. Mass. | 363.4959 | ||
SMILES | O=C(NC1C2CC3CC(C2)CC1C3)[C@H]1CCCN1Cc1ccc(cc1)C#N |r,wU:13.15,TLB:9:8:12:5.4.3,9:4:7.8.10:12,THB:3:4:7:10.11.12,3:11:7:5.9.4,2:3:7.8.10:12,(18.7,-42.55,;17.36,-43.3,;17.33,-44.84,;15.99,-45.59,;15.98,-47.12,;14.58,-47.47,;13.24,-46.98,;12.04,-48.26,;13.55,-47.83,;14.96,-48.4,;13.54,-46.25,;14.59,-45.01,;13.23,-45.49,;15.85,-42.79,;14.64,-43.77,;13.4,-42.86,;13.87,-41.4,;15.4,-41.39,;16.3,-40.14,;15.53,-38.8,;16.31,-37.47,;15.55,-36.14,;14.01,-36.13,;13.23,-37.47,;14,-38.8,;13.24,-34.79,;12.48,-33.46,)| | ||
Structure |