BDBM50402665 CHEMBL2206740

SMILES: O=C1N=C(NCCCCCCCNC2=NC(=O)C(S2)=Cc2ccc(o2)-c2ccccc2)SC1=Cc1ccc(o1)-c1ccccc1

InChI Key: InChIKey=USCRDFFSFPAXDS-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 = 50402665   

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))	BDBM50402665 (CHEMBL2206740) Show SMILES O=C1N=C(NCCCCCCCNC2=NC(=O)C(S2)=Cc2ccc(o2)-c2ccccc2)SC1=Cc1ccc(o1)-c1ccccc1 |w:33.37,19.20,t:2,13| Show InChI InChI=1S/C35H32N4O4S2/c40-32-30(22-26-16-18-28(42-26)24-12-6-4-7-13-24)44-34(38-32)36-20-10-2-1-3-11-21-37-35-39-33(41)31(45-35)23-27-17-19-29(43-27)25-14-8-5-9-15-25/h4-9,12-19,22-23H,1-3,10-11,20-21H2,(H,36,38,40)(H,37,39,41)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 1 mM dithiot...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair