| Reaction Details |
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 | Report a problem with these data |
| Target | Cathepsin S |
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| Ligand | BDBM50425903 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_933994 (CHEMBL2318072) |
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| IC50 | 1630±n/a nM |
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| Citation |  Wiener, JJ; Wickboldt, AT; Nguyen, S; Sun, S; Rynberg, R; Rizzolio, M; Karlsson, L; Edwards, JP; Grice, CA Pyrazole-based arylalkyne cathepsin S inhibitors. Part III: modification of P4 region. Bioorg Med Chem Lett23:1070-4 (2013) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| Cathepsin S |
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| Name: | Cathepsin S |
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| Synonyms: | CATS_HUMAN | CTSS | Cathepsin S (Cat S) | cathepsin S preproprotein |
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| Type: | Protein |
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| Mol. Mass.: | 37507.38 |
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| Organism: | Homo sapiens (Human) |
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| Description: | P25774 |
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| Residue: | 331 |
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| Sequence: | MKRLVCVLLVCSSAVAQLHKDPTLDHHWHLWKKTYGKQYKEKNEEAVRRLIWEKNLKFVM
LHNLEHSMGMHSYDLGMNHLGDMTSEEVMSLMSSLRVPSQWQRNITYKSNPNRILPDSVD
WREKGCVTEVKYQGSCGACWAFSAVGALEAQLKLKTGKLVSLSAQNLVDCSTEKYGNKGC
NGGFMTTAFQYIIDNKGIDSDASYPYKAMDQKCQYDSKYRAATCSKYTELPYGREDVLKE
AVANKGPVSVGVDARHPSFFLYRSGVYYEPSCTQNVNHGVLVVGYGDLNGKEYWLVKNSW
GHNFGEEGYIRMARNKGNHCGIASFPSYPEI
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| BDBM50425903 |
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| n/a |
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| Name | BDBM50425903 |
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| Synonyms: | CHEMBL2312992 |
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| Type | Small organic molecule |
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| Emp. Form. | C40H44Cl2N6O3 |
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| Mol. Mass. | 727.722 |
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| SMILES | Clc1ccc(CNCc2ccc(cc2)C#Cc2cc(ccc2Cl)-c2nn(CCCN3CCOCC3)c3CCN(Cc23)C(=O)N2CCOCC2)cc1 |
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| Structure | 
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