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Target11-beta-hydroxysteroid dehydrogenase 1
LigandBDBM50400158
Substrate/Competitorn/a
Meas. Tech.ChEMBL_878466 (CHEMBL2187380)
IC50 12±n/a nM
Citation Goldberg, FWLeach, AGScott, JSSnelson, WLGroombridge, SDDonald, CSBennett, SNBodin, CGutierrez, PMGyte, 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:
BDBM50400158
n/a
NameBDBM50400158
Synonyms:CHEMBL2179007
TypeSmall organic molecule
Emp. Form.C22H30N4O4
Mol. Mass.414.498
SMILESO[C@@]12CC3CC(C1)[C@H](NC(=O)c1cnc(NC4COC4)nc1OC1CCC1)C(C3)C2 |r,wU:7.8,wD:1.0,TLB:0:1:7:28.3.4,8:7:6.29.1:28.3.4,8:7:4:6.1.2,THB:0:1:7.27.28:4,2:1:7:28.3.4,2:3:7:6.29.1,29:27:4:6.1.2,29:1:7.27.28:4,(48.03,-46.21,;46.5,-46.19,;45.46,-45.07,;44.04,-45.62,;43.39,-46.89,;44.42,-47.97,;45.72,-47.41,;44.43,-49.71,;43.1,-50.49,;41.76,-49.73,;41.75,-48.18,;40.43,-50.5,;39.09,-49.74,;37.76,-50.51,;37.76,-52.05,;36.42,-52.82,;35.09,-52.05,;34.69,-50.56,;33.2,-50.96,;33.6,-52.45,;39.09,-52.83,;40.43,-52.05,;41.77,-52.82,;41.77,-54.36,;40.68,-55.45,;41.77,-56.54,;42.86,-55.45,;45.23,-48.39,;44.06,-47.06,;46.64,-47.82,)|
Structure
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