| Reaction Details |
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 | Report a problem with these data |
| Target | Cathepsin S |
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| Ligand | BDBM50208849 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_443352 (CHEMBL893600) |
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| Kd | 53.3±n/a nM |
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| Citation |  Bekkali, Y; Thomson, DS; Betageri, R; Emmanuel, MJ; Hao, MH; Hickey, E; Liu, W; Patel, U; Ward, YD; Young, ER; Nelson, R; Kukulka, A; Brown, ML; Crane, K; White, D; Freeman, DM; Labadia, ME; Wildeson, J; Spero, DM Identification of a novel class of succinyl-nitrile-based Cathepsin S inhibitors. Bioorg Med Chem Lett17:2465-9 (2007) [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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| BDBM50208849 |
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| n/a |
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| Name | BDBM50208849 |
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| Synonyms: | (R)-N-((R)-3-cyano-1-isobutylpyrrolidin-3-yl)-2-(cyclohexylmethyl)-4-morpholino-4-oxobutanamide | CHEMBL235121 |
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| Type | Small organic molecule |
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| Emp. Form. | C24H40N4O3 |
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| Mol. Mass. | 432.5994 |
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| SMILES | CC(C)CN1CC[C@](C1)(NC(=O)[C@H](CC1CCCCC1)CC(=O)N1CCOCC1)C#N |
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| Structure | 
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