Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '4-hydroxyphenylpyruvate dioxygenase' and Ligand = 'BDBM50024729'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
4-hydroxyphenylpyruvate dioxygenase (Homo sapiens (Human))	BDBM50024729 (CHEMBL3342430) Show SMILES Cc1nn(C)c(O)c1C(=O)c1ccc2nc(C)n(-c3ccc(C)cc3Cl)c(=O)c2c1 |(13.19,-60.25,;12.02,-59.25,;10.52,-59.6,;9.73,-58.28,;8.19,-58.16,;10.73,-57.11,;10.37,-55.61,;12.15,-57.71,;13.47,-56.91,;13.44,-55.37,;14.82,-57.66,;14.85,-59.2,;16.19,-59.94,;17.51,-59.15,;18.87,-59.89,;20.19,-59.09,;21.54,-59.83,;20.16,-57.54,;21.47,-56.74,;22.82,-57.48,;24.13,-56.69,;24.1,-55.15,;25.42,-54.34,;22.74,-54.4,;21.43,-55.21,;20.08,-54.47,;18.8,-56.79,;18.76,-55.25,;17.48,-57.6,;16.13,-56.86,)| Show InChI InChI=1S/C22H19ClN4O3/c1-11-5-8-18(16(23)9-11)27-13(3)24-17-7-6-14(10-15(17)21(27)29)20(28)19-12(2)25-26(4)22(19)30/h5-10,30H,1-4H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	109	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Central China Normal University Curated by ChEMBL					Assay Description Inhibition of purified His6-tagged recombinant human HPPD assessed as inhibition of maleylacetoacetate formation after 30 mins by UV/visible spectrop...				Bioorg Med Chem 22: 5194-211 (2014) Article DOI: 10.1016/j.bmc.2014.08.011 BindingDB Entry DOI: 10.7270/Q2DF6SRG
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