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Target
11-beta-hydroxysteroid dehydrogenase 1
Ligand
BDBM186151
Substrate
n/a
Meas. Tech.
Scintillation Proximity Assay
Temperature
298.15±n/a K
IC50
0.46±n/a nM
Comments
extracted
Citation
 Claremon, DA; Tice, CM; Zhuang, L; Leftheris, K; Ye, Y; Singh, SB Carbamate and urea inhibitors of 11β-hydroxysteroid dehydrogenase 1 US Patent  US9163012 Publication Date 10/20/2015 
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:
BDBM186151
Synonyms:
US9163012, 68
Type:
Small organic molecule
Emp. Form.:
C23H27ClN4O4
Mol. Mass.:
458.938
SMILES:
NC(=O)[C@@]12CC3CC(C1)[C@H](OC(=O)N1CC[C@H](C1)n1c4c(Cl)cccc4[nH]c1=O)C(C3)C2 |r,wU:9.10,16.19,wD:3.2,TLB:6:7:31:4.5.30,6:5:31:7.9.8,THB:9:7:4:31.29.30,9:29:4:7.6.8,10:9:31:4.5.30,(-8.38,-1.67,;-7.04,-2.44,;-7.04,-3.98,;-5.71,-1.67,;-6.54,-3.58,;-5.15,-2.93,;-3.94,-3.6,;-3.05,-1.67,;-4.38,-2.45,;-3.05,-.13,;-1.71,.64,;-.38,-.13,;-.38,-1.67,;.95,.64,;.95,2.18,;2.42,2.65,;3.32,1.41,;2.42,.16,;4.86,1.41,;5.77,.16,;5.45,-1.35,;3.96,-1.75,;6.59,-2.38,;8.06,-1.9,;8.38,-.4,;7.23,.64,;7.23,2.18,;5.77,2.65,;5,3.98,;-4.38,.63,;-5.13,-.53,;-5.71,-.13,)|
Structure:
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