BDBM50072247 4-(3,4-Dichloro-phenyl)-2-methyl-4-oxo-butyric acid::CHEMBL99769

SMILES: CC(CC(=O)c1ccc(Cl)c(Cl)c1)C(O)=O

InChI Key: InChIKey=LFVIGPLSBDXHSL-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50072247   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Kynurenine 3-monooxygenase (Rattus norvegicus)	BDBM50072247 (4-(3,4-Dichloro-phenyl)-2-methyl-4-oxo-butyric aci...) Show SMILES CC(CC(=O)c1ccc(Cl)c(Cl)c1)C(O)=O Show InChI InChI=1S/C11H10Cl2O3/c1-6(11(15)16)4-10(14)7-2-3-8(12)9(13)5-7/h2-3,5-6H,4H2,1H3,(H,15,16)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	3.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pharmacia& Upjohn Curated by ChEMBL					Assay Description Inhibition of rat brain KYN 3-OHase.				Bioorg Med Chem Lett 8: 2907-12 (1999) BindingDB Entry DOI: 10.7270/Q23X874K
					More data for this Ligand-Target Pair
Kynurenine 3-monooxygenase (Rattus norvegicus)	BDBM50072247 (4-(3,4-Dichloro-phenyl)-2-methyl-4-oxo-butyric aci...) Show SMILES CC(CC(=O)c1ccc(Cl)c(Cl)c1)C(O)=O Show InChI InChI=1S/C11H10Cl2O3/c1-6(11(15)16)4-10(14)7-2-3-8(12)9(13)5-7/h2-3,5-6H,4H2,1H3,(H,15,16)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	6.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pharmacia& Upjohn Curated by ChEMBL					Assay Description Inhibition of rat liver KYN 3-OHase.				Bioorg Med Chem Lett 8: 2907-12 (1999) BindingDB Entry DOI: 10.7270/Q23X874K
					More data for this Ligand-Target Pair