BDBM50318058 CHEMBL1099063::O5-Acetyl-O7-nitrooxyethyl chrysin

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

InChI Key: InChIKey=VQDIDXYXZUUTEY-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 = 50318058   

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))	BDBM50318058 (CHEMBL1099063 | O5-Acetyl-O7-nitrooxyethyl chrysin) Show SMILES CC(=O)Oc1cc(OCCO[N+]([O-])=O)cc2oc(cc(=O)c12)-c1ccccc1 Show InChI InChI=1S/C19H15NO8/c1-12(21)27-17-9-14(25-7-8-26-20(23)24)10-18-19(17)15(22)11-16(28-18)13-5-3-2-4-6-13/h2-6,9-11H,7-8H2,1H3	PDB GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	860	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