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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Calpain-1 catalytic subunit | ||
| Ligand | BDBM50104577 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEBML_43500 | ||
| IC50 | 21±n/a nM | ||
| Citation |  Josef, KA; Kauer, FW; Bihovsky, R Potent peptide alpha-ketohydroxamate inhibitors of recombinant human calpain I. Bioorg Med Chem Lett11:2615-7 (2001) [PubMed] | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Calpain-1 catalytic subunit | |||
| Name: | Calpain-1 catalytic subunit | ||
| Synonyms: | CAN1_HUMAN | CANPL1 | CAPN1 | Calpain ยต-type | Calpain-1 (u-Calpain) | Calpain-1 catalytic subunit | Calpain1 | ||
| Type: | Protein | ||
| Mol. Mass.: | 81880.51 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | n/a | ||
| Residue: | 714 | ||
| Sequence: |
| ||
| BDBM50104577 | |||
| n/a | |||
| Name | BDBM50104577 | ||
| Synonyms: | CHEMBL419311 | {(S)-1-[(S)-1-Benzyl-2-(4-methyl-cyclohexyloxycarbamoyl)-2-oxo-ethylcarbamoyl]-3-methyl-butyl}-carbamic acid benzyl ester | ||
| Type | Small organic molecule | ||
| Emp. Form. | C31H41N3O6 | ||
| Mol. Mass. | 551.6737 | ||
| SMILES | CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)C(=O)NOC1CCC(C)CC1 |wU:4.4,wD:19.19,(8.36,5.09,;8.96,3.66,;10.51,3.66,;7.86,2.55,;7.86,1.01,;6.53,.23,;5.2,1.01,;5.2,2.55,;3.87,.23,;2.53,1.01,;1.19,.23,;-.16,1.02,;-1.49,.25,;-1.49,-1.29,;-.13,-2.07,;1.19,-1.29,;9.2,.23,;9.2,-1.31,;10.55,1.01,;11.88,.23,;11.88,-1.31,;12.96,-2.39,;14.43,-1.99,;15.53,-3.06,;15.13,-4.56,;13.64,-4.94,;12.56,-3.87,;13.22,1.01,;13.22,2.55,;14.55,.23,;14.55,-1.31,;15.88,1.01,;17.22,.23,;18.57,1.01,;18.55,2.55,;19.91,3.31,;21.24,2.54,;22.57,3.31,;21.23,1,;19.9,.23,)| | ||
| Structure | 
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