Target
11-beta-hydroxysteroid dehydrogenase 1
Ligand
BDBM186136
Substrate
n/a
Meas. Tech.
Scintillation Proximity Assay
Temperature
298.15±n/a K
IC50
0.47±n/a nM
Comments
extracted
Citation
 Claremon, DATice, CMZhuang, LLeftheris, KYe, YSingh, 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:
BDBM186136
Synonyms:
US9163012, 53
Type:
Small organic molecule
Emp. Form.:
C24H29N3O3S
Mol. Mass.:
439.57
SMILES:
Cn1ccc(cc1=O)-c1csc(n1)[C@H]1CCCN1C(=O)OC1C2CC3CC(C2)CC1C3 |r,wD:13.14,TLB:20:21:23:25.26.27,THB:21:29:25:23.22.27,21:22:25:29.28.30,28:29:23:25.26.27,28:26:23:29.21.30,(3.94,-6.2,;3.54,-4.71,;2.06,-4.31,;1.66,-2.83,;2.75,-1.74,;4.23,-2.14,;4.63,-3.62,;6.12,-4.02,;2.35,-.25,;.88,.23,;.88,1.77,;2.35,2.24,;3.25,1,;3.12,3.57,;4.58,4.05,;4.58,5.59,;3.12,6.07,;2.21,4.82,;.72,4.42,;.32,2.94,;-.36,5.51,;-1.85,5.11,;-2.94,6.2,;-4.42,5.8,;-4.82,4.32,;-6.12,2.7,;-4.6,2.96,;-3.97,5.27,;-3.61,2,;-2.25,3.63,;-3.73,3.23,)|
Structure:
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