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Target
11-beta-hydroxysteroid dehydrogenase 1
Ligand
BDBM50430134
Substrate
n/a
Meas. Tech.
ChEMBL_942935 (CHEMBL2342884)
IC50
9.8±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 | 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:
MAFMKKYLLPILGLFMAYYYYSANEEFRPEMLQGKKVIVTGASKGIGREMAYHLAKMGAHVVVTARSKETLQKVVSHCLELGAASAHYIAGTMEDMTFAEQFVAQAGKLMGGLDMLILNHITNTSLNLFHDDIHHVRKSMEVNFLSYVVLTVAALPMLKQSNGSIVVVSSLAGKVAYPMVAAYSASKFALDGFFSSIRKEYSVSRVNVSITLCVLGLIDTETAMKAVSGIVHMQAAPKEECALEIIKGGALRQEEVYYDSSLWTTLLIRNPCRKILEFLYSTSYNMDRFINK
  
Inhibitor
Name:
BDBM50430134
Synonyms:
CHEMBL2338252
Type:
Small organic molecule
Emp. Form.:
C25H30ClN3O2
Mol. Mass.:
439.978
SMILES:
CC1(C)CCN([C@H]2C3CC4CC2C[C@@](O)(C4)C3)C(=O)c2cnn(c12)-c1cccc(Cl)c1 |r,wU:6.5,13.14,TLB:10:9:16:12.11.6,10:11:15.9.8:16,6:7:15:12.10.11,THB:6:11:15:8.7.16,5:6:15.9.8:16,(25.72,-45.66,;26.36,-47.06,;26.75,-45.56,;27.89,-47.1,;28.82,-48.33,;28.45,-49.82,;29.63,-50.81,;31.02,-50.22,;32.07,-51.45,;32.08,-53.03,;30.68,-53.61,;29.65,-52.34,;31.05,-52.68,;32.37,-52.18,;33.91,-52.15,;33.58,-53.44,;32.37,-50.69,;27.05,-50.45,;27.01,-51.99,;25.67,-49.76,;24.33,-50.51,;23.19,-49.47,;23.83,-48.07,;25.37,-48.24,;23.07,-46.74,;23.86,-45.41,;23.1,-44.07,;21.56,-44.06,;20.78,-45.39,;19.24,-45.39,;21.54,-46.73,)|
Structure:
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