| Reaction Details |
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 | Report a problem with these data |
| Target | Caspase-1 |
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| Ligand | BDBM50282979 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEBML_91007 |
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| Ki | 27±n/a nM |
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| Citation |  Mjalli, AM; Chapman, KT; MacCoss, M; Thornberry, NA; Peterson, EP Activated ketones as potent reversible inhibitors of interleukin-Iβ converting enzyme Bioorg Med Chem Lett4:1965-1968 (1994) Article |
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| More Info.: | Get all data from this article, Assay Method |
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| Caspase-1 |
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| Name: | Caspase-1 |
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| Synonyms: | CASP1 | CASP1_HUMAN | Caspase | Caspase 1 | ICE | IL1BC | IL1BCE | Interleukin-1 beta convertase | Interleukin-1 beta-converting enzyme |
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| Type: | Enzyme |
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| Mol. Mass.: | 45154.13 |
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| Organism: | Homo sapiens (Human) |
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| Description: | P29466 |
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| Residue: | 404 |
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| Sequence: | MADKVLKEKRKLFIRSMGEGTINGLLDELLQTRVLNKEEMEKVKRENATVMDKTRALIDS
VIPKGAQACQICITYICEEDSYLAGTLGLSADQTSGNYLNMQDSQGVLSSFPAPQAVQDN
PAMPTSSGSEGNVKLCSLEEAQRIWKQKSAEIYPIMDKSSRTRLALIICNEEFDSIPRRT
GAEVDITGMTMLLQNLGYSVDVKKNLTASDMTTELEAFAHRPEHKTSDSTFLVFMSHGIR
EGICGKKHSEQVPDILQLNAIFNMLNTKNCPSLKDKPKVIIIQACRGDSPGVVWFKDSVG
VSGNLSLPTTEEFEDDAIKKAHIEKDFIAFCSSTPDNVSWRHPTMGSVFIGRLIEHMQEY
ACSCDVEEIFRKVRFSFEQPDGRAQMPTTERVTLTRCFYLFPGH
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| BDBM50282979 |
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| n/a |
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| Name | BDBM50282979 |
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| Synonyms: | 3-{(S)-2-[(S)-3-Methyl-2-(3-phenyl-propionylamino)-butyrylamino]-propionylamino}-4-oxo-5-(3-phenyl-propane-1-sulfinyl)-pentanoic acid | CHEMBL58894 |
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| Type | Small organic molecule |
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| Emp. Form. | C31H41N3O7S |
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| Mol. Mass. | 599.738 |
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| SMILES | CC(C)[C@H](NC(=O)CCc1ccccc1)C(=O)N[C@@H](C)C(=O)NC(CC(O)=O)C(=O)CS(=O)CCCc1ccccc1 |
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| Structure | 
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