Reaction Details |
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Target | Beta-secretase 1 |
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Ligand | BDBM50392770 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_853104 (CHEMBL2154572) |
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IC50 | 0.990000±n/a nM |
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Citation | Kaller, MR; Harried, SS; Albrecht, B; Amarante, P; Babu-Khan, S; Bartberger, MD; Brown, J; Brown, R; Chen, K; Cheng, Y; Citron, M; Croghan, MD; Graceffa, R; Hickman, D; Judd, T; Kriemen, C; La, D; Li, V; Lopez, P; Luo, Y; Masse, C; Monenschein, H; Nguyen, T; Pennington, LD; Miguel, TS; Sickmier, EA; Wahl, RC; Weiss, MM; Wen, PH; Williamson, T; Wood, S; Xue, M; Yang, B; Zhang, J; Patel, V; Zhong, W; Hitchcock, S A Potent and Orally Efficacious, Hydroxyethylamine-Based Inhibitor of ß-Secretase. ACS Med Chem Lett3:886-891 (2012) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Beta-secretase 1 |
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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: | MAQALPWLLLWMGAGVLPAHGTQHGIRLPLRSGLGGAPLGLRLPRETDEEPEEPGRRGSF
VEMVDNLRGKSGQGYYVEMTVGSPPQTLNILVDTGSSNFAVGAAPHPFLHRYYQRQLSST
YRDLRKGVYVPYTQGKWEGELGTDLVSIPHGPNVTVRANIAAITESDKFFINGSNWEGIL
GLAYAEIARPDDSLEPFFDSLVKQTHVPNLFSLQLCGAGFPLNQSEVLASVGGSMIIGGI
DHSLYTGSLWYTPIRREWYYEVIIVRVEINGQDLKMDCKEYNYDKSIVDSGTTNLRLPKK
VFEAAVKSIKAASSTEKFPDGFWLGEQLVCWQAGTTPWNIFPVISLYLMGEVTNQSFRIT
ILPQQYLRPVEDVATSQDDCYKFAISQSSTGTVMGAVIMEGFYVVFDRARKRIGFAVSAC
HVHDEFRTAAVEGPFVTLDMEDCGYNIPQTDESTLMTIAYVMAAICALFMLPLCLMVCQW
RCLRCLRQQHDDFADDISLLK
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BDBM50392770 |
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n/a |
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Name | BDBM50392770 |
Synonyms: | CHEMBL2151243 |
Type | Small organic molecule |
Emp. Form. | C29H40FN3O3 |
Mol. Mass. | 497.6446 |
SMILES | CC(=O)N[C@@H](Cc1ccc(C)c(F)c1)[C@H](O)CN[C@H]1CC2(CCC2)Oc2ncc(CC(C)(C)C)cc12 |r| |
Structure |
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