BDBM50437457 CHEMBL2409352

SMILES: CCCCOc1cc(O)c2c(c1)oc(cc2=O)-c1ccc2OCCOc2c1

InChI Key: InChIKey=NIQKIKPMFAZZRN-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 = 50437457   

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
Aldose reductase (ALR2) (Bos taurus (Cattle))	BDBM50437457 (CHEMBL2409352) Show SMILES CCCCOc1cc(O)c2c(c1)oc(cc2=O)-c1ccc2OCCOc2c1 Show InChI InChI=1S/C21H20O6/c1-2-3-6-24-14-10-15(22)21-16(23)12-18(27-20(21)11-14)13-4-5-17-19(9-13)26-8-7-25-17/h4-5,9-12,22H,2-3,6-8H2,1H3	PDB GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.25E+3	n/a	n/a	n/a	n/a	n/a	n/a
Xiangtan University Curated by ChEMBL					Assay Description Inhibition of bovine lens aldose reductase using DL-glyceraldehyde as substrate assessed as NADPH oxidation measured for 10 mins by spectrophotometri...				Bioorg Med Chem 21: 4301-10 (2013) Article DOI: 10.1016/j.bmc.2013.04.066 BindingDB Entry DOI: 10.7270/Q2BZ67GT
					More data for this Ligand-Target Pair