Reaction Details | |||
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Target | Matrix metalloproteinase-9 | ||
Ligand | BDBM50457777 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_1760639 (CHEMBL4195647) | ||
IC50 | 25430±n/a nM | ||
Citation | Wang, CG; Yao, WN; Zhang, B; Hua, J; Liang, D; Wang, HS Lung cancer and matrix metalloproteinases inhibitors of polyphenols from Selaginella tamariscina with suppression activity of migration. Bioorg Med Chem Lett28:2413-2417 (2018) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
Matrix metalloproteinase-9 | |||
Name: | Matrix metalloproteinase-9 | ||
Synonyms: | 67 kDa matrix metalloproteinase-9 | 82 kDa matrix metalloproteinase-9 | 92 kDa gelatinase | 92 kDa type IV collagenase | CLG4B | GELB | Gelatinase B | MMP-9 | MMP9 | MMP9_HUMAN | Matrix metalloproteinase 9 (MMP-9) | Matrix metalloproteinase-9 (MMP-9) | Matrix metalloproteinase-9 (MMP9) | ||
Type: | Enzyme | ||
Mol. Mass.: | 78452.28 | ||
Organism: | Homo sapiens (Human) | ||
Description: | P14780 | ||
Residue: | 707 | ||
Sequence: |
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BDBM50457777 | |||
n/a | |||
Name | BDBM50457777 | ||
Synonyms: | CHEMBL4216342 | ||
Type | Small organic molecule | ||
Emp. Form. | C31H24O10 | ||
Mol. Mass. | 556.5163 | ||
SMILES | COc1ccc(cc1-c1c(O)cc2OC(CC(=O)c2c1O)c1ccc(O)cc1)C1CC(=O)c2c(O)cc(O)cc2O1 |(14.03,-42.29,;14.02,-40.75,;12.69,-39.98,;11.35,-40.75,;10.01,-39.98,;10.02,-38.43,;11.35,-37.66,;12.68,-38.43,;14.01,-37.65,;14,-36.12,;12.66,-35.36,;15.33,-35.34,;16.67,-36.1,;18,-35.33,;19.34,-36.1,;19.34,-37.64,;18,-38.41,;18,-39.95,;16.67,-37.65,;15.35,-38.42,;15.35,-39.96,;20.67,-35.33,;22,-36.1,;23.34,-35.33,;23.34,-33.79,;24.67,-33.02,;22,-33.02,;20.67,-33.79,;8.68,-37.66,;8.69,-36.12,;7.36,-35.35,;7.36,-33.81,;6.03,-36.12,;4.7,-35.34,;4.71,-33.8,;3.36,-36.11,;3.36,-37.65,;2.03,-38.42,;4.69,-38.42,;6.02,-37.66,;7.35,-38.44,)| | ||
Structure |