Reaction Details
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11-beta-hydroxysteroid dehydrogenase 1
Ligand
BDBM186160
Substrate
n/a
Meas. Tech.
Homogeneous Time Resolved Fluorescence Assay
pH
6±n/a
Temperature
310.15±n/a K
IC50
>10000±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 More Info.:
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:
BDBM186160
Synonyms:
US9163012, 77
Type:
Small organic molecule
Emp. Form.:
C21H25N3O4
Mol. Mass.:
383.4409
SMILES:
OC12CC3CC(C1)C(OC(=O)N1CC[C@H](C1)n1cc(ccc1=O)C#N)C(C3)C2 |r,wU:14.17,TLB:4:5:27:2.3.26,4:3:27:5.7.6,THB:7:5:2:27.25.26,7:25:2:5.4.6,8:7:27:2.3.26,(-7.88,-1.14,;-6.54,-1.91,;-7.38,-3.81,;-5.98,-3.17,;-4.78,-3.84,;-3.88,-1.91,;-5.21,-2.68,;-3.88,-.37,;-2.55,.4,;-1.22,-.37,;-1.22,-1.91,;.12,.4,;.12,1.94,;1.58,2.41,;2.49,1.17,;1.58,-.08,;4.03,1.17,;4.8,-.16,;6.42,-.24,;7.11,1.17,;6.34,2.5,;4.8,2.5,;4.03,3.84,;7.21,-1.56,;8,-2.89,;-5.21,.4,;-5.97,-.77,;-6.54,-.37,)|
Structure:
