Reaction Details |
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Target | Interstitial collagenase |
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Ligand | BDBM50246797 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_557952 (CHEMBL963050) |
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IC50 | 350±n/a nM |
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Citation | Ledour, G; Moroy, G; Rouffet, M; Bourguet, E; Guillaume, D; Decarme, M; Elmourabit, H; Augé, F; Alix, AJ; Laronze, JY; Bellon, G; Hornebeck, W; Sapi, J Introduction of the 4-(4-bromophenyl)benzenesulfonyl group to hydrazide analogs of Ilomastat leads to potent gelatinase B (MMP-9) inhibitors with improved selectivity. Bioorg Med Chem16:8745-59 (2008) [PubMed] Article |
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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 |
Synonyms: | CLG | Fibroblast collagenase | MMP1 | MMP1_HUMAN | Matrix metalloproteinase-1 | Matrix metalloproteinase-1 (MMP-1) |
Type: | Enzyme |
Mol. Mass.: | 54010.26 |
Organism: | Homo sapiens (Human) |
Description: | P03956 |
Residue: | 469 |
Sequence: | MHSFPPLLLLLFWGVVSHSFPATLETQEQDVDLVQKYLEKYYNLKNDGRQVEKRRNSGPV
VEKLKQMQEFFGLKVTGKPDAETLKVMKQPRCGVPDVAQFVLTEGNPRWEQTHLTYRIEN
YTPDLPRADVDHAIEKAFQLWSNVTPLTFTKVSEGQADIMISFVRGDHRDNSPFDGPGGN
LAHAFQPGPGIGGDAHFDEDERWTNNFREYNLHRVAAHELGHSLGLSHSTDIGALMYPSY
TFSGDVQLAQDDIDGIQAIYGRSQNPVQPIGPQTPKACDSKLTFDAITTIRGEVMFFKDR
FYMRTNPFYPEVELNFISVFWPQLPNGLEAAYEFADRDEVRFFKGNKYWAVQGQNVLHGY
PKDIYSSFGFPRTVKHIDAALSEENTGKTYFFVANKYWRYDEYKRSMDPGYPKMIAHDFP
GIGHKVDAVFMKDGFFYFFHGTRQYKFDPKTKRILTLQKANSWFNCRKN
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BDBM50246797 |
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n/a |
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Name | BDBM50246797 |
Synonyms: | CHEMBL502674 | N'-{3-(R)-[2-(S)-(2-Phenyl-1H-indol-3-yl)-1-(methylcarbamoyl)-ethylcarbamoyl]-5-methylhexanoyl}-N-4-(4-bromophenyl)benzenesulfonylhydrazide |
Type | Small organic molecule |
Emp. Form. | C38H40BrN5O5S |
Mol. Mass. | 758.724 |
SMILES | CNC(=O)[C@H](Cc1c([nH]c2ccccc12)-c1ccccc1)NC(=O)[C@H](CC(C)C)CC(=O)NNS(=O)(=O)c1ccc(cc1)-c1ccc(Br)cc1 |r| |
Structure |
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