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Target
11-beta-hydroxysteroid dehydrogenase 1
Ligand
BDBM50448234
Substrate
n/a
Meas. Tech.
ChEMBL_1293357 (CHEMBL3122300)
IC50
54±n/a nM
Citation
 Lee, Y; Shin, YJ; Ahn, SK 3-Amino-N-adamantyl-3-methylbutanamide derivatives as 11ß-hydroxysteroid dehydrogenase 1 inhibitor. Bioorg Med Chem Lett 24:1421-5 (2014) [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:
BDBM50448234
Synonyms:
CHEMBL3120759
Type:
Small organic molecule
Emp. Form.:
C23H33ClN2O5S2
Mol. Mass.:
517.102
SMILES:
Cc1c(Cl)cccc1S(=O)(=O)NC(C)(C)CC(=O)N[C@H]1C2CC3CC1C[C@](C3)(C2)S(C)(=O)=O |r,wU:19.19,wD:26.32,TLB:28:26:23:21.20.19,18:19:23:25.27.26,THB:29:26:23:21.20.19,27:22:19:25.26.28,27:26:23.22.21:19,28:20:23:25.27.26,(2.64,-18.38,;2.64,-16.84,;1.31,-16.07,;-.04,-16.84,;1.31,-14.53,;2.64,-13.76,;3.98,-14.52,;3.98,-16.07,;5.32,-16.84,;4.55,-18.18,;6.09,-18.17,;6.65,-16.07,;7.98,-16.84,;8.76,-18.17,;7.58,-18.32,;9.32,-16.06,;10.65,-16.83,;10.65,-18.37,;11.98,-16.06,;13.25,-16.94,;14.59,-16.45,;13.56,-17.69,;13.58,-19.28,;12.08,-19.71,;13.27,-18.42,;14.6,-18.91,;15.99,-18.56,;14.98,-19.83,;15.99,-17.02,;17.35,-19.27,;17.41,-20.81,;18.89,-19.21,;18.07,-17.91,)|
Structure:
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