Reaction Details |
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Target | Collagenase 3 |
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Ligand | BDBM50185884 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_361730 (CHEMBL870168) |
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IC50 | 1.4±n/a nM |
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Citation | Zhang, YM; Fan, X; Xiang, B; Chakravarty, D; Scannevin, R; Burke, S; Karnachi, P; Rhodes, K; Jackson, P Synthesis and SAR of alpha-sulfonylcarboxylic acids as potent matrix metalloproteinase inhibitors. Bioorg Med Chem Lett16:3096-100 (2006) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Collagenase 3 |
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Name: | Collagenase 3 |
Synonyms: | MMP-13 | MMP13 | MMP13_HUMAN | Matrix metalloproteinase-13 | Matrix metalloproteinase-13 (MMP-13) | Matrix metalloproteinase-13 (MMP13) |
Type: | Enzyme |
Mol. Mass.: | 53808.06 |
Organism: | Homo sapiens (Human) |
Description: | P45452 |
Residue: | 471 |
Sequence: | MHPGVLAAFLFLSWTHCRALPLPSGGDEDDLSEEDLQFAERYLRSYYHPTNLAGILKENA
ASSMTERLREMQSFFGLEVTGKLDDNTLDVMKKPRCGVPDVGEYNVFPRTLKWSKMNLTY
RIVNYTPDMTHSEVEKAFKKAFKVWSDVTPLNFTRLHDGIADIMISFGIKEHGDFYPFDG
PSGLLAHAFPPGPNYGGDAHFDDDETWTSSSKGYNLFLVAAHEFGHSLGLDHSKDPGALM
FPIYTYTGKSHFMLPDDDVQGIQSLYGPGDEDPNPKHPKTPDKCDPSLSLDAITSLRGET
MIFKDRFFWRLHPQQVDAELFLTKSFWPELPNRIDAAYEHPSHDLIFIFRGRKFWALNGY
DILEGYPKKISELGLPKEVKKISAAVHFEDTGKTLLFSGNQVWRYDDTNHIMDKDYPRLI
EEDFPGIGDKVDAVYEKNGYIYFFNGPIQFEYSIWSNRIVRVMPANSILWC
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BDBM50185884 |
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n/a |
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Name | BDBM50185884 |
Synonyms: | 4-(1,3-dioxo-1,3-dihydro-isoindol-2-yl)-2-(4-p-tolylethynyl-benzenesulfonyl)-butyric acid | CHEMBL210517 |
Type | Small organic molecule |
Emp. Form. | C27H21NO6S |
Mol. Mass. | 487.524 |
SMILES | Cc1ccc(cc1)C#Cc1ccc(cc1)S(=O)(=O)C(CCN1C(=O)c2ccccc2C1=O)C(O)=O |
Structure |
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