| Reaction Details |
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 | Report a problem with these data |
| Target | Beta-secretase 1 [1-460] |
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| Ligand | BDBM224809 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | BACE1 FRET Assay |
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| pH | 4.6±n/a |
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| Temperature | 298.15±n/a K |
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| IC50 | 73.4±13.8 nM |
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| Comments | extracted |
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| Citation |  Martin, FM; Mergott, DJ; Owton, WM BACE inhibitors US Patent US9328124 Publication Date 5/3/2016 |
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| More Info.: | Get all data from this article, Assay Method |
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| |
| Beta-secretase 1 [1-460] |
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| Name: | Beta-secretase 1 [1-460] |
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| Synonyms: | BACE | BACE1 | BACE1_HUMAN | Beta-secretase 1 (BACE1) | Beta-secretase 1 (aa 1-460) | KIAA1149 |
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| Type: | Protein |
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| Mol. Mass.: | 50987.78 |
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| Organism: | Homo sapiens (Human) |
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| Description: | P56817[1-460] |
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| Residue: | 460 |
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| Sequence: | MAQALPWLLLWMGAGVLPAHGTQHGIRLPLRSGLGGAPLGLRLPRETDEEPEEPGRRGSF
VEMVDNLRGKSGQGYYVEMTVGSPPQTLNILVDTGSSNFAVGAAPHPFLHRYYQRQLSST
YRDLRKGVYVPYTQGKWEGELGTDLVSIPHGPNVTVRANIAAITESDKFFINGSNWEGIL
GLAYAEIARPDDSLEPFFDSLVKQTHVPNLFSLQLCGAGFPLNQSEVLASVGGSMIIGGI
DHSLYTGSLWYTPIRREWYYEVIIVRVEINGQDLKMDCKEYNYDKSIVDSGTTNLRLPKK
VFEAAVKSIKAASSTEKFPDGFWLGEQLVCWQAGTTPWNIFPVISLYLMGEVTNQSFRIT
ILPQQYLRPVEDVATSQDDCYKFAISQSSTGTVMGAVIMEGFYVVFDRARKRIGFAVSAC
HVHDEFRTAAVEGPFVTLDMEDCGYNIPQTDESTLMTIAY
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| BDBM224809 |
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| n/a |
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| Name | BDBM224809 |
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| Synonyms: | US9328124, 12 |
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| Type | Small organic molecule |
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| Emp. Form. | C18H20F2N6OS |
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| Mol. Mass. | 406.453 |
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| SMILES | CC(C)(O)c1nc(ncc1F)N1C[C@H]2CSC(N)=N[C@]2(C1)c1ccc(F)cn1 |r,c:18| |
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| Structure | 
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