Reaction Details |
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Target | Caspase-3 |
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Ligand | BDBM50257354 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_562695 (CHEMBL1012730) |
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IC50 | 5120±n/a nM |
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Citation | Podichetty, AK; Faust, A; Kopka, K; Wagner, S; Schober, O; Schäfers, M; Haufe, G Fluorinated isatin derivatives. Part 1: synthesis of new N-substituted (S)-5-[1-(2-methoxymethylpyrrolidinyl)sulfonyl]isatins as potent caspase-3 and -7 inhibitors. Bioorg Med Chem17:2680-8 (2009) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Caspase-3 |
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Name: | Caspase-3 |
Synonyms: | Apopain | CASP-3 | CASP3 | CASP3_HUMAN | CPP-32 | CPP32 | Caspase 3 | Caspase-3 subunit p12 | Caspase-3 subunit p17 | Cysteine protease CPP32 | SCA-1 | SREBP cleavage activity 1 | Yama protein | caspase-3 preproprotein |
Type: | Hydrolase; heterotetramer of two heterodimers |
Mol. Mass.: | 31607.55 |
Organism: | Homo sapiens (Human) |
Description: | n/a |
Residue: | 277 |
Sequence: | MENTENSVDSKSIKNLEPKIIHGSESMDSGISLDNSYKMDYPEMGLCIIINNKNFHKSTG
MTSRSGTDVDAANLRETFRNLKYEVRNKNDLTREEIVELMRDVSKEDHSKRSSFVCVLLS
HGEEGIIFGTNGPVDLKKITNFFRGDRCRSLTGKPKLFIIQACRGTELDCGIETDSGVDD
DMACHKIPVEADFLYAYSTAPGYYSWRNSKDGSWFIQSLCAMLKQYADKLEFMHILTRVN
RKVATEFESFSFDATFHAKKQIPCIVSMLTKELYFYH
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BDBM50257354 |
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n/a |
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Name | BDBM50257354 |
Synonyms: | (S)-1-(3-Fluoropropyl)-5-[1-(2-methoxymethylpyrrolidinyl)sulfonyl]isatin | CHEMBL494737 |
Type | Small organic molecule |
Emp. Form. | C17H21FN2O5S |
Mol. Mass. | 384.422 |
SMILES | COC[C@@H]1CCCN1S(=O)(=O)c1ccc2N(CCCF)C(=O)C(=O)c2c1 |r| |
Structure |
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