BDBM50434635 CHEMBL2385099

SMILES: COc1cccc(NS(=O)(=O)c2cc3OCC(=O)Nc3cc2Cl)c1

InChI Key: InChIKey=AEIVNSJTXSKRFO-UHFFFAOYSA-N

Data: 1 EC50

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 = 50434635   

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 kinase (PKM2) (Homo sapiens (Human))	BDBM50434635 (CHEMBL2385099) Show SMILES COc1cccc(NS(=O)(=O)c2cc3OCC(=O)Nc3cc2Cl)c1 Show InChI InChI=1S/C15H13ClN2O5S/c1-22-10-4-2-3-9(5-10)18-24(20,21)14-7-13-12(6-11(14)16)17-15(19)8-23-13/h2-7,18H,8H2,1H3,(H,17,19)	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	22	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Activation of PKM2 in human Huh7 cells assessed as production of pyruvate and ATP by fluorescence assay				Bioorg Med Chem Lett 23: 3358-63 (2013) Article DOI: 10.1016/j.bmcl.2013.03.090 BindingDB Entry DOI: 10.7270/Q2XW4M6M
					More data for this Ligand-Target Pair