Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 485.9 BDBM50279373

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

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 (Rattus norvegicus)	BDBM50279373 (6-chloro-N-(4-(4-(cyclopropyl(hydroxy)methylene)-1...) Show SMILES Fc1ccc(CN2C(CCCCNC(=O)c3ccc(Cl)nc3)C(=O)C(C(=O)C3CC3)C2=O)cc1 Show InChI InChI=1S/C25H25ClFN3O4/c26-20-11-8-17(13-29-20)24(33)28-12-2-1-3-19-23(32)21(22(31)16-6-7-16)25(34)30(19)14-15-4-9-18(27)10-5-15/h4-5,8-11,13,16,19,21H,1-3,6-7,12,14H2,(H,28,33)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bayer CropScience AG Curated by ChEMBL					Assay Description Inhibition of rat 4-hydroxyphenylpyruvate dioxygenase				Bioorg Med Chem 17: 4035-46 (2009) Article DOI: 10.1016/j.bmc.2009.03.027 BindingDB Entry DOI: 10.7270/Q2KK9BP8
					More data for this Ligand-Target Pair