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Target
Beta-secretase 1
Ligand
BDBM50491241
Substrate
n/a
Meas. Tech.
ChEMBL_960199 (CHEMBL2382571)
IC50
630±n/a nM
Citation
 Ginman, T; Viklund, J; Malmström, J; Blid, J; Emond, R; Forsblom, R; Johansson, A; Kers, A; Lake, F; Sehgelmeble, F; Sterky, KJ; Bergh, M; Lindgren, A; Johansson, P; Jeppsson, F; Fälting, J; Gravenfors, Y; Rahm, F Core refinement toward permeable ?-secretase (BACE-1) inhibitors with low hERG activity. J Med Chem 56:4181-205 (2013) [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:
BDBM50491241
Synonyms:
CHEMBL2380453
Type:
Small organic molecule
Emp. Form.:
C19H21FN4
Mol. Mass.:
324.3952
SMILES:
[H][C@]12CCCCN1[C@](C)(N=C2N)c1cccc(c1)-c1cncc(F)c1 |r,c:10|
Structure:
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