| Reaction Details |
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 | Report a problem with these data |
| Target | Caspase-1 |
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| Ligand | BDBM50602630 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_2241713 (CHEMBL5155923) |
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| IC50 | 53500±n/a nM |
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| Citation |  Ulgheri, F; Spanu, P; Deligia, F; Loriga, G; Fuggetta, MP; de Haan, I; Chandgudge, A; Groves, M; Domling, A Design, synthesis and biological evaluation of 1,5-disubstituted ?-amino tetrazole derivatives as non-covalent inflammasome-caspase-1 complex inhibitors with potential application against immune and inflammatory disorders. Eur J Med Chem229:0 (2022) [PubMed] 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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| BDBM50602630 |
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| n/a |
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| Name | BDBM50602630 |
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| Synonyms: | CHEMBL5178554 |
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| Type | Small organic molecule |
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| Emp. Form. | C25H29N6NaO4 |
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| Mol. Mass. | 500.5253 |
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| SMILES | [Na;v0+].[#8]-[#6](-[#6]-[#7]-[#6@@H](-c1nnnn1-[#6]-[#6]-[#6]-[#6](=O)-[#7]-1-[#6]-[#6]-c2ccccc2-[#6]-1)-c1ccccc1)-[#6]-[#6](-[#8-])=O |r| |
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| Structure | 
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