Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetBeta-secretase 1 [1-458]
LigandBDBM195529
Substrate/Competitorn/a
Meas. Tech.BACE Enzyme Assay (Ex.435)
pH4.4±n/a
IC50 3.4±n/a nM
Commentsextracted
Citation Cacatian, SClaremon, DADillard, LWFuchs, KHeine, NJia, LLeftheris, KMcKeever, BMorales-Ramos, ASingh, SBVenkatraman, SWu, GWu, ZXu, ZYuan, JZheng, Y Inhibitors of beta-secretase US Patent US9212153 Publication Date 12/15/2015
More Info.:Get all data from this article,  Assay Method
 
Beta-secretase 1 [1-458]
Name:Beta-secretase 1 [1-458]
Synonyms:BACE | BACE1 | BACE1_HUMAN | Beta-secretase 1 (aa 1-458) | KIAA1149
Type:n/a
Mol. Mass.:50753.53
Organism:Homo sapiens (Human)
Description:Truncation 1-458 aa with His-tag at C-terminus
Residue:458
Sequence:
MAQALPWLLLWMGAGVLPAHGTQHGIRLPLRSGLGGAPLGLRLPRETDEEPEEPGRRGSF
VEMVDNLRGKSGQGYYVEMTVGSPPQTLNILVDTGSSNFAVGAAPHPFLHRYYQRQLSST
YRDLRKGVYVPYTQGKWEGELGTDLVSIPHGPNVTVRANIAAITESDKFFINGSNWEGIL
GLAYAEIARPDDSLEPFFDSLVKQTHVPNLFSLQLCGAGFPLNQSEVLASVGGSMIIGGI
DHSLYTGSLWYTPIRREWYYEVIIVRVEINGQDLKMDCKEYNYDKSIVDSGTTNLRLPKK
VFEAAVKSIKAASSTEKFPDGFWLGEQLVCWQAGTTPWNIFPVISLYLMGEVTNQSFRIT
ILPQQYLRPVEDVATSQDDCYKFAISQSSTGTVMGAVIMEGFYVVFDRARKRIGFAVSAC
HVHDEFRTAAVEGPFVTLDMEDCGYNIPQTDESTLMTI
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM195529
n/a
NameBDBM195529
Synonyms:US10336717, Compound 397 | US9212153, 397,Ex. 336
TypeSmall organic molecule
Emp. Form.C27H25FN4O
Mol. Mass.440.512
SMILESCN1C(N)=N[C@@]2(C1=O)c1cc(ccc1CC21CCc2ccccc2CC1)-c1cccnc1F |r,c:3|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: