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Target
11-beta-hydroxysteroid dehydrogenase 1
Ligand
BDBM50537916
Substrate
n/a
Meas. Tech.
ChEMBL_1970845 (CHEMBL4603663)
IC50
68±n/a nM
Citation
 Lee, JH; Bok, JH; Park, SB; Pagire, HS; Na, YJ; Rim, E; Jung, WH; Song, JS; Kang, NS; Seo, HW; Jung, KY; Lee, BH; Kim, KY; Ahn, JH Optimization of cyclic sulfamide derivatives as 11?-hydroxysteroid dehydrogenase 1 inhibitors for the potential treatment of ischemic brain injury. Bioorg Med Chem Lett 30:0 (2020) [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 1 | 11beta-HSD1A | Corticosteroid 11-beta-dehydrogenase isozyme 1 | Corticosteroid 11-beta-dehydrogenase isozyme 1 (11-beta-HSD-1) | DHI1_MOUSE | Hsd11 | Hsd11b1
Type:
Enzyme
Mol. Mass.:
32369.70
Organism:
Mus musculus (mouse)
Description:
P50172
Residue:
292
Sequence:
MAVMKNYLLPILVLFLAYYYYSTNEEFRPEMLQGKKVIVTGASKGIGREMAYHLSKMGAHVVLTARSEEGLQKVVSRCLELGAASAHYIAGTMEDMTFAEQFIVKAGKLMGGLDMLILNHITQTSLSLFHDDIHSVRRVMEVNFLSYVVMSTAALPMLKQSNGSIAVISSLAGKMTQPMIAPYSASKFALDGFFSTIRTELYITKVNVSITLCVLGLIDTETAMKEISGIINAQASPKEECALEIIKGTALRKSEVYYDKSPLTPILLGNPGRKIMEFFSLRYYNKDMFVSN
  
Inhibitor
Name:
BDBM50537916
Synonyms:
CHEMBL4646414
Type:
Small organic molecule
Emp. Form.:
C27H32Cl2N4O5S
Mol. Mass.:
595.538
SMILES:
CC1CN(CC(=O)NC2C3CC4CC2CC(C4)(C3)C(N)=O)S(=O)(=O)N(C1)c1c(Cl)cc(cc1Cl)-c1ccco1 |TLB:12:13:17:10.11.16,12:11:8.13.14:17,7:8:10.12.11:14.15.17,7:8:17:10.11.16,THB:16:11:8:14.15.17,16:15:8:10.12.11,(12.15,-11.25,;12.13,-12.79,;13.45,-13.57,;13.43,-15.11,;14.76,-15.89,;16.1,-15.13,;16.11,-13.59,;17.42,-15.91,;18.76,-15.16,;20.52,-15.2,;21.04,-16.53,;22.23,-17.35,;20.59,-17.44,;20.08,-16.01,;21.26,-14.94,;22.89,-14.9,;23.38,-16.34,;21.63,-14.21,;24.21,-14.12,;25.55,-14.89,;24.2,-12.58,;12.09,-15.87,;12.86,-17.2,;11.32,-17.19,;10.77,-15.08,;10.79,-13.54,;9.43,-15.84,;9.42,-17.37,;10.75,-18.15,;8.08,-18.13,;6.75,-17.34,;6.77,-15.8,;8.11,-15.05,;8.13,-13.51,;5.4,-18.1,;5.22,-19.63,;3.71,-19.93,;2.96,-18.59,;4,-17.46,)|
Structure:
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