Reaction Details | |||
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Target | 4-hydroxyphenylpyruvate dioxygenase | ||
Ligand | BDBM50264309 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_1698554 (CHEMBL4049536) | ||
Ki | 7.0±n/a nM | ||
Citation | Santucci, A; Bernardini, G; Braconi, D; Petricci, E; Manetti, F 4-Hydroxyphenylpyruvate Dioxygenase and Its Inhibition in Plants and Animals: Small Molecules as Herbicides and Agents for the Treatment of Human Inherited Diseases. J Med Chem60:4101-4125 (2017) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
4-hydroxyphenylpyruvate dioxygenase | |||
Name: | 4-hydroxyphenylpyruvate dioxygenase | ||
Synonyms: | 1.13.11.27 | 4-hydroxyphenylpyruvate dioxygenase | 4-hydroxyphenylpyruvic acid oxidase | 4HPPD | HPD | HPPD_ARATH | PDS1 | ||
Type: | PROTEIN | ||
Mol. Mass.: | 48808.34 | ||
Organism: | Arabidopsis thaliana | ||
Description: | ChEMBL_105530 | ||
Residue: | 445 | ||
Sequence: |
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BDBM50264309 | |||
n/a | |||
Name | BDBM50264309 | ||
Synonyms: | CHEMBL4060588 | ||
Type | Small organic molecule | ||
Emp. Form. | C19H16N2O3 | ||
Mol. Mass. | 320.3419 | ||
SMILES | CC1CC(=O)C(C(=O)c2cc3cccc(C)c3nc2C#N)C(=O)C1 |(52.99,-30.01,;54.32,-29.24,;54.32,-27.7,;55.65,-26.92,;55.65,-25.38,;56.98,-27.7,;58.32,-26.93,;58.32,-25.39,;59.65,-27.71,;59.64,-29.25,;60.97,-30.02,;60.97,-31.55,;62.3,-32.32,;63.63,-31.55,;63.63,-30.02,;64.96,-29.24,;62.3,-29.25,;62.31,-27.71,;60.98,-26.94,;60.97,-25.41,;60.97,-23.87,;56.98,-29.24,;58.31,-30.01,;55.65,-30,)| | ||
Structure |