BDBM50264095 (3-Carboxymethylsulfanyl-1,4-dioxo-1,4-dihydro-naphthalen-2-ylsulfanyl)-acetic acid::CHEMBL489995

SMILES: OC(=O)CSC1=C(SCC(O)=O)C(=O)c2ccccc2C1=O

InChI Key: InChIKey=DLPXDGDDLLFSPQ-UHFFFAOYSA-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 = 50264095   

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
Dual specificity phosphatase Cdc25B (Homo sapiens (Human))	BDBM50264095 ((3-Carboxymethylsulfanyl-1,4-dioxo-1,4-dihydro-nap...) Show SMILES OC(=O)CSC1=C(SCC(O)=O)C(=O)c2ccccc2C1=O |c:5| Show InChI InChI=1S/C14H10O6S2/c15-9(16)5-21-13-11(19)7-3-1-2-4-8(7)12(20)14(13)22-6-10(17)18/h1-4H,5-6H2,(H,15,16)(H,17,18)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.75E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of human recombinant CDC25B				Bioorg Med Chem 16: 9040-9 (2008) Article DOI: 10.1016/j.bmc.2008.08.009 BindingDB Entry DOI: 10.7270/Q2833SZB
					More data for this Ligand-Target Pair