| Reaction Details |
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 | Report a problem with these data |
| Target | Legumain |
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| Ligand | BDBM50378276 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_589116 (CHEMBL1038469) |
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| IC50 | 0.37±n/a nM |
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| Citation |  Ovat, A; Muindi, F; Fagan, C; Brouner, M; Hansell, E; Dvorák, J; Sojka, D; Kopácek, P; McKerrow, JH; Caffrey, CR; Powers, JC Aza-peptidyl Michael acceptor and epoxide inhibitors--potent and selective inhibitors of Schistosoma mansoni and Ixodes ricinus legumains (asparaginyl endopeptidases). J Med Chem52:7192-210 (2009) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| Legumain |
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| Name: | Legumain |
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| Synonyms: | Asparaginyl Endopeptidase (AE) | Legumain-like protease precursor |
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| Type: | Enzyme |
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| Mol. Mass.: | 49038.15 |
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| Organism: | Ixodes ricinus |
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| Description: | IrAE was expressed and produced in Pichia pastoris. |
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| Residue: | 441 |
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| Sequence: | MLSLRSILSLLALASLFLVASGTSVPTSKSQASADAKLWALLVAGSNGYYNYRHQADICH
AYHVLHNHGIPDERIVVMMYDDIAHDPSNPTPGIIINHLNGSNVYAGVPKDYTGDLVTPK
NFLSILQGKKIKGGSGKVIASGPNDHVFVFFADHGAPGLIAFPNDDLQATNLSRVIKRMH
KQKKFGKLVFYVEACESGSMFENLLPDDINVYATTAANSDESSYACYYDDLRQTYLGDVY
SVNWMEDSDREDLHKETLLKQFKIVRSETNTSHVMEFGDLKIANLKVSEFQGAKSTPPIV
LPKAPLDAVDSRDVPIAIVRKKLQKATDPQIKLSLKHELDQMLRNRAFLKEKMVEIVSFV
ALGDAEKTEQLLKAKIPLRDHTCYEQAVRYFDTTCFELSANPHALAHLRLLVNMCEEKIS
VSEIREAMDNVCTHPTVIGIV
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| BDBM50378276 |
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| n/a |
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| Name | BDBM50378276 |
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| Synonyms: | CHEMBL582898 |
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| Type | Small organic molecule |
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| Emp. Form. | C47H50N8O8 |
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| Mol. Mass. | 854.9487 |
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| SMILES | C[C@@H](NC(=O)N1CCN(CC1)C(=O)OCc1ccccc1)C(=O)N[C@@H](C)C(=O)NN(CC(N)=O)C(=O)C=CC(=O)N(Cc1cccc2ccccc12)Cc1cccc2ccccc12 |r,w:36.37| |
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| Structure | 
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