Search and Browse
Download
Enter Data
| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Beta-secretase 1 | ||
| Ligand | BDBM160683 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | Fluorescence Quench Assay | ||
| pH | 4.5±n/a | ||
| Temperature | 298.15±n/a K | ||
| IC50 | 14±n/a nM | ||
| Comments | extracted | ||
| Citation |  Dillard, LW; Yuan, J; Leftheris, K; Venkatraman, S; Wu, G; Jia, L; Xu, Z; Cacatian, S; Morales-Ramos, A; Singh, SB; Zheng, Y Inhibitors of beta-secretase US Patent US9045500 Publication Date 6/2/2015 | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Beta-secretase 1 | |||
| 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: |
| ||
| BDBM160683 | |||
| n/a | |||
| Name | BDBM160683 | ||
| Synonyms: | US9045500, 5 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C25H29N5O | ||
| Mol. Mass. | 415.5307 | ||
| SMILES | COC1CCC2(Cc3ccc(cc3C22N=C(N)N3CCCN=C23)-c2cccnc2)CC1 |t:16,23,(7.84,-1.4,;6.5,-2.17,;5.17,-1.4,;4.08,-2.49,;2.74,-1.72,;1.2,-1.72,;.3,-2.97,;-1.17,-2.49,;-2.5,-3.26,;-3.84,-2.49,;-3.84,-.95,;-2.5,-.18,;-1.17,-.95,;.3,-.48,;-.9,.49,;-.35,1.93,;-1.12,3.26,;1.19,1.85,;2.28,2.94,;3.77,2.54,;4.16,1.05,;3.08,-.04,;1.59,.36,;-5.17,-.18,;-6.5,-.95,;-7.84,-.18,;-7.84,1.36,;-6.5,2.13,;-5.17,1.36,;2.29,-.63,;3.63,-1.4,)| | ||
| Structure | 
| ||