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Target
11-beta-hydroxysteroid dehydrogenase 1
Ligand
BDBM50430138
Substrate
n/a
Meas. Tech.
ChEMBL_942934 (CHEMBL2342883)
IC50
18±n/a nM
Citation
 Udagawa, S; Sakami, S; Takemura, T; Sato, M; Arai, T; Nitta, A; Aoki, T; Kawai, K; Iwamura, T; Okazaki, S; Takahashi, T; Kaino, M Discovery of novel 7-membered cyclic amide derivatives that inhibit 11beta-hydroxysteroid dehydrogenase type 1. Bioorg Med Chem Lett 23:1617-21 (2013) [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 | 11beta-HSD1A | Corticosteroid 11-beta-dehydrogenase isozyme 1 | Corticosteroid 11-beta-dehydrogenase isozyme 1 (11-beta-HSD-1) | DHI1_MOUSE | Hsd11 | Hsd11b1
Type:
Enzyme
Mol. Mass.:
32369.70
Organism:
Mouse
Description:
P50172
Residue:
292
Sequence:
MAVMKNYLLPILVLFLAYYYYSTNEEFRPEMLQGKKVIVTGASKGIGREMAYHLSKMGAHVVLTARSEEGLQKVVSRCLELGAASAHYIAGTMEDMTFAEQFIVKAGKLMGGLDMLILNHITQTSLSLFHDDIHSVRRVMEVNFLSYVVMSTAALPMLKQSNGSIAVISSLAGKMTQPMIAPYSASKFALDGFFSTIRTELYITKVNVSITLCVLGLIDTETAMKEISGIINAQASPKEECALEIIKGTALRKSEVYYDKSPLTPILLGNPGRKIMEFFSLRYYNKDMFVSN
  
Inhibitor
Name:
BDBM50430138
Synonyms:
CHEMBL2338248
Type:
Small organic molecule
Emp. Form.:
C26H33N3O3
Mol. Mass.:
435.5585
SMILES:
COc1ccccc1-n1ncc2c1C(C)(C)CCN([C@H]1C3CC4CC1C[C@@](O)(C4)C3)C2=O |r,wU:19.20,26.29,TLB:23:22:29:25.24.19,23:24:28.22.21:29,19:20:28:25.23.24,THB:19:24:28:21.20.29,18:19:28.22.21:29,(23.46,-21.38,;25,-21.39,;25.78,-20.06,;25.01,-18.73,;25.79,-17.39,;27.34,-17.4,;28.09,-18.74,;27.31,-20.07,;28.07,-21.4,;27.43,-22.81,;28.56,-23.85,;29.91,-23.09,;29.6,-21.58,;30.59,-20.4,;29.96,-18.99,;30.98,-18.9,;32.12,-20.44,;33.06,-21.67,;32.68,-23.16,;33.86,-24.15,;35.25,-23.56,;36.3,-24.78,;36.31,-26.37,;34.91,-26.94,;33.89,-25.68,;35.29,-26.01,;36.61,-25.51,;38.14,-25.49,;37.82,-26.77,;36.6,-24.02,;31.28,-23.79,;31.25,-25.33,)|
Structure:
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