Reaction Details Report a problem with these data
Target
11-beta-hydroxysteroid dehydrogenase 1
Ligand
BDBM50195490
Substrate
n/a
Meas. Tech.
ChEMBL_425005 (CHEMBL912530)
Ki
20±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 Lett 16:6241-5 (2006) [PubMed]  Article 
Target
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:
MKKYLLPVLVLCLGYYYSTNEEFRPEMLQGKKVIVTGASKGIGREMAYHLSKMGAHVVLTARSEEGLQKVVSRCLELGAASAHYIAGTMEDMAFAERFVVEAGKLLGGLDMLILNHITQTTMSLFHDDIHSVRRSMEVNFLSYVVLSTAALPMLKQSNGSIAIISSMAGKMTQPLIASYSASKFALDGFFSTIRKEHLMTKVNVSITLCVLGFIDTETALKETSGIILSQAAPKEECALEIIKGTVLRKDEVYYDKSSWTPLLLGNPGRRIMEFLSLRSYNRDLFVSN
  
Inhibitor
Name:
BDBM50195490
Synonyms:
2-((1s,4s)-4-(4-amino-3,5-dichloro-N-cyclopropylbenzamido)cyclohexanecarboxamido)acetic acid | CHEMBL374318
Type:
Small organic molecule
Emp. Form.:
C19H23Cl2N3O4
Mol. Mass.:
428.31
SMILES:
Nc1c(Cl)cc(cc1Cl)C(=O)N(C1CC1)[C@H]1CC[C@H](CC1)C(=O)NCC(O)=O |wU:15.16,18.23,(25.2,-26.37,;23.86,-25.6,;23.86,-24.05,;25.19,-23.27,;22.52,-23.29,;21.19,-24.06,;21.19,-25.6,;22.52,-26.37,;22.52,-27.91,;19.86,-23.29,;19.86,-21.75,;18.52,-24.06,;17.19,-23.29,;16.42,-21.95,;15.65,-23.29,;18.52,-25.6,;19.86,-26.36,;19.85,-27.91,;18.52,-28.68,;17.19,-27.9,;17.19,-26.37,;18.51,-30.22,;17.17,-30.98,;19.84,-30.99,;19.84,-32.53,;21.17,-33.31,;21.16,-34.85,;22.5,-32.54,)|
Structure:
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