Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
Target11-beta-hydroxysteroid dehydrogenase 1
LigandBDBM186097
Substrate/Competitorn/a
Meas. Tech.Scintillation Proximity Assay
Temperature298.15±n/a K
IC50 5.39±n/a nM
Commentsextracted
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
More Info.:Get all data from this article,  Assay Method
 
11-beta-hydroxysteroid dehydrogenase 1
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:
MAFMKKYLLPILGLFMAYYYYSANEEFRPEMLQGKKVIVTGASKGIGREMAYHLAKMGAH
VVVTARSKETLQKVVSHCLELGAASAHYIAGTMEDMTFAEQFVAQAGKLMGGLDMLILNH
ITNTSLNLFHDDIHHVRKSMEVNFLSYVVLTVAALPMLKQSNGSIVVVSSLAGKVAYPMV
AAYSASKFALDGFFSSIRKEYSVSRVNVSITLCVLGLIDTETAMKAVSGIVHMQAAPKEE
CALEIIKGGALRQEEVYYDSSLWTTLLIRNPCRKILEFLYSTSYNMDRFINK
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM186097
n/a
NameBDBM186097
Synonyms:US9163012, 15
TypeSmall organic molecule
Emp. Form.C26H35NO5
Mol. Mass.441.5598
SMILESCOC(=O)COCC1(CCN(CC1)C(=O)OC1C2CC3CC(C2)CC1C3)c1ccccc1 |TLB:15:16:18:20.21.22,THB:16:24:20:18.17.22,16:17:20:24.23.25,23:24:18:20.21.22,23:21:18:24.16.25,(-7.01,5.55,;-7.78,4.22,;-7.01,2.89,;-7.78,1.55,;-5.47,2.89,;-4.7,1.55,;-3.16,1.55,;-2.39,.22,;-1.05,.99,;.28,.22,;.28,-1.32,;-1.05,-2.09,;-2.39,-1.32,;1.61,-2.09,;1.62,-3.63,;2.95,-1.32,;4.28,-2.09,;5.61,-1.32,;6.94,-2.09,;6.94,-3.63,;7.78,-5.53,;6.38,-4.89,;6.37,-2.49,;5.18,-5.55,;4.28,-3.63,;5.61,-4.4,;-3.72,-.55,;-5.06,.22,;-6.39,-.55,;-6.39,-2.09,;-5.06,-2.86,;-3.72,-2.09,)|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: