| Reaction Details |
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 | Report a problem with these data |
| Target | Interstitial collagenase |
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| Ligand | BDBM50104007 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_105958 (CHEMBL715371) |
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| IC50 | 654±n/a nM |
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| Citation |  Hanessian, S; MacKay, DB; Moitessier, N Design and synthesis of matrix metalloproteinase inhibitors guided by molecular modeling. Picking the S(1) pocket using conformationally constrained inhibitors. J Med Chem44:3074-82 (2001) [PubMed] |
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| More Info.: | Get all data from this article, Assay Method |
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| Interstitial collagenase |
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| Name: | Interstitial collagenase |
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| Synonyms: | CLG | Fibroblast collagenase | MMP1 | MMP1_HUMAN | Matrix metalloproteinase-1 | Matrix metalloproteinase-1 (MMP-1) |
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| Type: | Enzyme |
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| Mol. Mass.: | 54010.26 |
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| Organism: | Homo sapiens (Human) |
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| Description: | P03956 |
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| Residue: | 469 |
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| Sequence: | MHSFPPLLLLLFWGVVSHSFPATLETQEQDVDLVQKYLEKYYNLKNDGRQVEKRRNSGPV
VEKLKQMQEFFGLKVTGKPDAETLKVMKQPRCGVPDVAQFVLTEGNPRWEQTHLTYRIEN
YTPDLPRADVDHAIEKAFQLWSNVTPLTFTKVSEGQADIMISFVRGDHRDNSPFDGPGGN
LAHAFQPGPGIGGDAHFDEDERWTNNFREYNLHRVAAHELGHSLGLSHSTDIGALMYPSY
TFSGDVQLAQDDIDGIQAIYGRSQNPVQPIGPQTPKACDSKLTFDAITTIRGEVMFFKDR
FYMRTNPFYPEVELNFISVFWPQLPNGLEAAYEFADRDEVRFFKGNKYWAVQGQNVLHGY
PKDIYSSFGFPRTVKHIDAALSEENTGKTYFFVANKYWRYDEYKRSMDPGYPKMIAHDFP
GIGHKVDAVFMKDGFFYFFHGTRQYKFDPKTKRILTLQKANSWFNCRKN
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| BDBM50104007 |
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| n/a |
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| Name | BDBM50104007 |
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| Synonyms: | 1-(4-Methoxy-benzenesulfonyl)-4,4-dimethyl-3-phenethylsulfanylmethyl-pyrrolidine-2-carboxylic acid hydroxyamide | CHEMBL102698 |
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| Type | Small organic molecule |
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| Emp. Form. | C23H30N2O5S2 |
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| Mol. Mass. | 478.625 |
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| SMILES | COc1ccc(cc1)S(=O)(=O)N1CC(C)(C)C(CSCCc2ccccc2)[C@@H]1C(=O)NO |
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| Structure | 
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