| Reaction Details |
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 | Report a problem with these data |
| Target | Caspase-5 |
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| Ligand | BDBM166683 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_1622627 (CHEMBL3864979) |
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| IC50 | 910±n/a nM |
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| Citation |  Kent, CR; Bryja, M; Gustafson, HA; Kawarski, MY; Lenti, G; Pierce, EN; Knopp, RC; Ceja, V; Pati, B; Walters, DE; Karver, CE Variation of the aryl substituent on the piperazine ring within the 4-(piperazin-1-yl)-2,6-di(pyrrolidin-1-yl)pyrimidine scaffold unveils potent, non-competitive inhibitors of the inflammatory caspases. Bioorg Med Chem Lett26:5476-5480 (2016) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| Caspase-5 |
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| Name: | Caspase-5 |
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| Synonyms: | CASP-5 | CASP5 | CASP5_HUMAN | Caspase 5 | Caspase-5 subunit p10 | Caspase-5 subunit p20 | ICE(rel)-III | ICH-3 protease | ICH3 | Protease ICH-3 | Protease TY | TY protease |
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| Type: | Enzyme |
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| Mol. Mass.: | 49760.80 |
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| Organism: | Homo sapiens (Human) |
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| Description: | P51878 |
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| Residue: | 434 |
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| Sequence: | MAEDSGKKKRRKNFEAMFKGILQSGLDNFVINHMLKNNVAGQTSIQTLVPNTDQKSTSVK
KDNHKKKTVKMLEYLGKDVLHGVFNYLAKHDVLTLKEEEKKKYYDTKIEDKALILVDSLR
KNRVAHQMFTQTLLNMDQKITSVKPLLQIEAGPPESAESTNILKLCPREEFLRLCKKNHD
EIYPIKKREDRRRLALIICNTKFDHLPARNGAHYDIVGMKRLLQGLGYTVVDEKNLTARD
MESVLRAFAARPEHKSSDSTFLVLMSHGILEGICGTAHKKKKPDVLLYDTIFQIFNNRNC
LSLKDKPKVIIVQACRGEKHGELWVRDSPASLALISSQSSENLEADSVCKIHEEKDFIAF
CSSTPHNVSWRDRTRGSIFITELITCFQKYSCCCHLMEIFRKVQKSFEVPQAKAQMPTIE
RATLTRDFYLFPGN
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| BDBM166683 |
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| n/a |
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| Name | BDBM166683 |
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| Synonyms: | U74389G (B9) |
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| Type | Small organic molecule |
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| Emp. Form. | C37H50N6O2 |
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| Mol. Mass. | 610.8319 |
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| SMILES | C[C@]12CC=C3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1CC[C@@H]2C(=O)CN1CCN(CC1)c1cc(nc(n1)N1CCCC1)N1CCCC1 |r,c:3,12,t:8| |
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| Structure | 
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