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Target11-beta-hydroxysteroid dehydrogenase 1
LigandBDBM50400165
Substrate/Competitorn/a
Meas. Tech.ChEMBL_878466 (CHEMBL2187380)
IC50 26±n/a nM
Citation Goldberg, FW; Leach, AG; Scott, JS; Snelson, WL; Groombridge, SD; Donald, CS; Bennett, SN; Bodin, C; Gutierrez, PM; Gyte, AC Free-Wilson and structural approaches to co-optimizing human and rodent isoform potency for 11ß-hydroxysteroid dehydrogenase type 1 (11ß-HSD1) inhibitors. J Med Chem55:10652-61 (2012) [PubMed]  Article
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
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  Blast E-value cutoff:
BDBM50400165
n/a
NameBDBM50400165
Synonyms:CHEMBL2179028
TypeSmall organic molecule
Emp. Form.C23H34N4O3
Mol. Mass.414.5411
SMILESC[C@@H](O)CNc1ncc(C(=O)N[C@H]2C3CC4CC2C[C@](O)(C4)C3)c(n1)C1CCCC1 |r,wU:12.11,1.1,wD:19.20,TLB:20:19:12:16.15.14,11:12:22.18.19:16.15.14,11:12:14:22.19.21,THB:20:19:12.17.16:14,21:19:12:16.15.14,21:15:12:22.18.19,18:17:14:22.19.21,18:19:12.17.16:14,(60.94,-27.35,;60.94,-25.81,;59.6,-25.04,;62.27,-25.04,;63.61,-25.81,;64.94,-25.04,;64.94,-23.5,;66.27,-22.73,;67.61,-23.49,;68.94,-22.71,;68.93,-21.17,;70.27,-23.48,;71.6,-22.7,;71.6,-20.96,;70.56,-19.88,;71.21,-18.61,;71.24,-20.05,;72.4,-21.38,;73.82,-20.81,;73.67,-19.19,;75.21,-19.2,;72.63,-18.07,;72.89,-20.4,;67.61,-25.04,;66.27,-25.81,;68.95,-25.81,;69.11,-27.33,;70.62,-27.65,;71.39,-26.32,;70.35,-25.17,)|
Structure
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