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Target
11-beta-hydroxysteroid dehydrogenase 1
Ligand
BDBM50120378
Substrate
n/a
Meas. Tech.
ChEMBL_1518302 (CHEMBL3620277)
IC50
74±n/a nM
Citation
 Leiva, R; Seira, C; McBride, A; Binnie, M; Luque, FJ; Bidon-Chanal, A; Webster, SP; Vázquez, S Novel 11ß-HSD1 inhibitors: C-1 versus C-2 substitution and effect of the introduction of an oxygen atom in the adamantane scaffold. Bioorg Med Chem Lett 25:4250-3 (2015) [PubMed]  Article 
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:
BDBM50120378
Synonyms:
CHEMBL3616709
Type:
Small organic molecule
Emp. Form.:
C17H20Cl2N2O
Mol. Mass.:
339.259
SMILES:
Nc1c(Cl)cc(cc1Cl)C(=O)NC1C2CC3CC(C2)CC1C3 |TLB:18:17:21:14.13.12,18:13:16.17.19:21,THB:12:13:16:19.20.21,12:20:16:14.18.13,11:12:16.17.19:21,(8.9,3.57,;7.81,3.01,;6.51,3.85,;6.58,5.08,;5.14,3.15,;5.06,1.61,;6.35,.77,;7.73,1.47,;8.76,.8,;3.69,.91,;3.62,-.32,;2.4,1.76,;1.01,1.05,;-.28,1.69,;-1.04,.44,;-1.04,-1.32,;-2.25,-2.11,;-1.85,-.7,;-2.02,.73,;-.4,-.88,;1.11,-.36,;.37,-1.59,)|
Structure:
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