BDBM50025302 2-(3,4-Dihydroxy-phenyl)-5-hydroxy-7,8-dimethoxy-chromen-4-one::2-(3,4-dihydroxyphenyl)-5-hydroxy-7,8-dimethoxy-4H-chromen-4-one::CHEMBL76188

SMILES: COc1cc(O)c2c(oc(cc2=O)-c2ccc(O)c(O)c2)c1OC

InChI Key: InChIKey=FWOUQLGHGBDLRO-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 = 50025302   

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 (Rattus norvegicus)	BDBM50025302 (2-(3,4-Dihydroxy-phenyl)-5-hydroxy-7,8-dimethoxy-c...) Show SMILES COc1cc(O)c2c(oc(cc2=O)-c2ccc(O)c(O)c2)c1OC Show InChI InChI=1S/C17H14O7/c1-22-14-7-12(21)15-11(20)6-13(24-17(15)16(14)23-2)8-3-4-9(18)10(19)5-8/h3-7,18-19,21H,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	77.6	n/a	n/a	n/a	n/a	n/a	n/a
INIFTA (UNLP, CCT La Plata-CONICET) Curated by ChEMBL					Assay Description Inhibition of rat lens aldose reductase				Bioorg Med Chem 16: 7470-6 (2008) Article DOI: 10.1016/j.bmc.2008.06.004 BindingDB Entry DOI: 10.7270/Q2862HQJ
					More data for this Ligand-Target Pair
Arachidonate 5-lipoxygenase (Rattus norvegicus)	BDBM50025302 (2-(3,4-Dihydroxy-phenyl)-5-hydroxy-7,8-dimethoxy-c...) Show SMILES COc1cc(O)c2c(oc(cc2=O)-c2ccc(O)c(O)c2)c1OC Show InChI InChI=1S/C17H14O7/c1-22-14-7-12(21)15-11(20)6-13(24-17(15)16(14)23-2)8-3-4-9(18)10(19)5-8/h3-7,18-19,21H,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Ability to inhibit 5-lipoxygenase in rat basophilic leukemia cells.				J Med Chem 29: 2256-62 (1986) BindingDB Entry DOI: 10.7270/Q2M907P5
					More data for this Ligand-Target Pair