| Reaction Details |
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 | Report a problem with these data |
| Target | Caspase-1 |
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| Ligand | BDBM50290011 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEBML_91011 |
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| Ki | 900±n/a nM |
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| Citation |  Golec, JM; Mullican, MD; Murcko, MA; Wilson, KP; Kay, DP; Jones, SD; Murdoch, R; Bemis, GW; Raybuck, SA; Luong, YP; Livingston, DJ Structure-based design of non-peptidic pyridone aldehydes as inhibitors of interleukin-1β converting enzyme Bioorg Med Chem Lett7:2181-2186 (1997) 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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| BDBM50290011 |
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| n/a |
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| Name | BDBM50290011 |
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| Synonyms: | (S)-4-Oxo-3-{2-[2-oxo-6-phenyl-3-(3-phenyl-propionylamino)-2H-pyridin-1-yl]-acetylamino}-butyric acid | CHEMBL68669 |
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| Type | Small organic molecule |
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| Emp. Form. | C26H25N3O6 |
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| Mol. Mass. | 475.4932 |
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| SMILES | OC(=O)C[C@H](NC(=O)Cn1c(ccc(NC(=O)CCc2ccccc2)c1=O)-c1ccccc1)C=O |
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| Structure | 
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