BDBM50318052 (5-hydroxy-4-oxo-2-phenyl-4H-chromen-7-yloxy)methyl 3-(nitrooxy)propanoate::CHEMBL1095398

SMILES: Oc1cc(OCOC(=O)CCO[N+]([O-])=O)cc2oc(cc(=O)c12)-c1ccccc1

InChI Key: InChIKey=VOGZJGHJCDRRIM-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 = 50318052   

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))	BDBM50318052 ((5-hydroxy-4-oxo-2-phenyl-4H-chromen-7-yloxy)methy...) Show SMILES Oc1cc(OCOC(=O)CCO[N+]([O-])=O)cc2oc(cc(=O)c12)-c1ccccc1 Show InChI InChI=1S/C19H15NO9/c21-14-8-13(26-11-27-18(23)6-7-28-20(24)25)9-17-19(14)15(22)10-16(29-17)12-4-2-1-3-5-12/h1-5,8-10,21H,6-7,11H2	PDB GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
Central South University Curated by ChEMBL					Assay Description Inhibition of aldose reductase from calf lense by AR assay				Bioorg Med Chem 18: 3020-5 (2010) Article DOI: 10.1016/j.bmc.2010.03.056 BindingDB Entry DOI: 10.7270/Q2W66KX5
					More data for this Ligand-Target Pair