BDBM50472658 CHEMBL73337

SMILES: C[C@@](O)(C(=O)Nc1ccc(cc1Cl)C(=O)N1CCOCC1)C(F)(F)F

InChI Key: InChIKey=XNGVNSXRRADPSC-CQSZACIVSA-N

Data: 1 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 1 hit for monomerid = 50472658   

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
Pyruvate dehydrogenase kinase (Homo sapiens (Human))	BDBM50472658 (CHEMBL73337) Show SMILES C[C@@](O)(C(=O)Nc1ccc(cc1Cl)C(=O)N1CCOCC1)C(F)(F)F Show InChI InChI=1S/C15H16ClF3N2O4/c1-14(24,15(17,18)19)13(23)20-11-3-2-9(8-10(11)16)12(22)21-4-6-25-7-5-21/h2-3,8,24H,4-7H2,1H3,(H,20,23)/t14-/m1/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	130	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institute for Biomedical Research Curated by ChEMBL					Assay Description Inhibition of porcine pyruvate dehydrogenase kinase (PDHK)in a primary enzymatic assay				J Med Chem 43: 2248-57 (2000) Article DOI: 10.1021/jm0000923 BindingDB Entry DOI: 10.7270/Q2C82D1Z
					More data for this Ligand-Target Pair