BDBM50104679 4-Hydroxy-5-hydroxymethyl-2-oxo-2,5-dihydro-furan-3-carboxylic acid decyl ester::CHEMBL111085

SMILES: CCCCCCCCCCOC(=O)c1c(O)oc(CO)c1O

InChI Key: InChIKey=RJGZQAYMLBLYMT-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 = 50104679   

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 (Mus musculus)	BDBM50104679 (4-Hydroxy-5-hydroxymethyl-2-oxo-2,5-dihydro-furan-...) Show SMILES CCCCCCCCCCOC(=O)c1c(O)oc(CO)c1O Show InChI InChI=1S/C16H26O6/c1-2-3-4-5-6-7-8-9-10-21-15(19)13-14(18)12(11-17)22-16(13)20/h17-18,20H,2-11H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Tohoku University Curated by ChEMBL					Assay Description Inhibitory activity against cell division cycle 25B				J Med Chem 44: 3216-22 (2001) BindingDB Entry DOI: 10.7270/Q2WD3ZVR
					More data for this Ligand-Target Pair
Dual specificity protein phosphatase (VHR) (Homo sapiens (Human))	BDBM50104679 (4-Hydroxy-5-hydroxymethyl-2-oxo-2,5-dihydro-furan-...) Show SMILES CCCCCCCCCCOC(=O)c1c(O)oc(CO)c1O Show InChI InChI=1S/C16H26O6/c1-2-3-4-5-6-7-8-9-10-21-15(19)13-14(18)12(11-17)22-16(13)20/h17-18,20H,2-11H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>2.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
Tohoku University Curated by ChEMBL					Assay Description Inhibitory activity against vaccinia VH1-related phosphatase(VHR)				J Med Chem 44: 3216-22 (2001) BindingDB Entry DOI: 10.7270/Q2WD3ZVR
					More data for this Ligand-Target Pair