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Target
Beta-secretase 1
Ligand
BDBM50300176
Substrate
n/a
Meas. Tech.
ChEMBL_594469 (CHEMBL1041518)
IC50
1500±n/a nM
Citation
 Meredith, JA; Björklund, C; Adolfsson, H; Jansson, K; Hallberg, A; Rosenquist, A; Samuelsson, B P2'-truncated BACE-1 inhibitors with a novel hydroxethylene-like core. Eur J Med Chem 45:542-54 (2010) [PubMed]  Article 
Target
Name:
Beta-secretase 1
Synonyms:
ASP2 | Asp 2 | Aspartyl protease 2 | BACE | BACE1 | BACE1_HUMAN | Beta-secretase (BACE) | Beta-secretase 1 | Beta-secretase 1 (BACE 1) | Beta-secretase 1 (BACE-1) | Beta-secretase 1 (BACE1) | Beta-site APP cleaving enzyme 1 | Beta-site amyloid precursor protein cleaving enzyme 1 | KIAA1149 | Memapsin-2 | Membrane-associated aspartic protease 2 | beta-Secretase (BACE-1) | beta-Secretase (BACE1)
Type:
Protein
Mol. Mass.:
55755.10
Organism:
Homo sapiens (Human)
Description:
P56817
Residue:
501
Sequence:
MAQALPWLLLWMGAGVLPAHGTQHGIRLPLRSGLGGAPLGLRLPRETDEEPEEPGRRGSFVEMVDNLRGKSGQGYYVEMTVGSPPQTLNILVDTGSSNFAVGAAPHPFLHRYYQRQLSSTYRDLRKGVYVPYTQGKWEGELGTDLVSIPHGPNVTVRANIAAITESDKFFINGSNWEGILGLAYAEIARPDDSLEPFFDSLVKQTHVPNLFSLQLCGAGFPLNQSEVLASVGGSMIIGGIDHSLYTGSLWYTPIRREWYYEVIIVRVEINGQDLKMDCKEYNYDKSIVDSGTTNLRLPKKVFEAAVKSIKAASSTEKFPDGFWLGEQLVCWQAGTTPWNIFPVISLYLMGEVTNQSFRITILPQQYLRPVEDVATSQDDCYKFAISQSSTGTVMGAVIMEGFYVVFDRARKRIGFAVSACHVHDEFRTAAVEGPFVTLDMEDCGYNIPQTDESTLMTIAYVMAAICALFMLPLCLMVCQWRCLRCLRQQHDDFADDISLLK
  
Inhibitor
Name:
BDBM50300176
Synonyms:
2-Ethyl-6-methyl-7,7-dioxo-6,7,8,9-tetrahydro-7lambda6-thia-6,9adiaza-benzo[cd]azulene-carboxylic acid [1S-(3,5-difluoro-phenoxymethyl)-2S-hydroxy-4R-methoxy-5-(4-methoxy-benzyloxy)-pentyl]-amide | CHEMBL583304
Type:
Small organic molecule
Emp. Form.:
C35H41F2N3O8S
Mol. Mass.:
701.777
SMILES:
CCc1cn2CCS(=O)(=O)N(C)c3ccc(C(=O)N[C@@H](COc4cc(F)cc(F)c4)[C@@H](O)C[C@H](COCc4ccc(OC)cc4)OC)c1c23 |r|
Structure:
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