BDBM50292353 CHEMBL471479::Percicarin::Persicarin

SMILES: COc1cc(ccc1O)-c1oc2cc(O)cc(=O)c2c(O)c1OS([O-])(=O)=O

InChI Key: InChIKey=ITXOAHNKLPOCTD-UHFFFAOYSA-M

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 = 50292353   

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
Xanthine dehydrogenase (Bos taurus (Bovine))	BDBM50292353 (CHEMBL471479 | Percicarin | Persicarin) Show SMILES COc1cc(ccc1O)-c1oc2cc(O)cc(=O)c2c(O)c1OS([O-])(=O)=O Show InChI InChI=1S/C16H12O10S/c1-24-11-4-7(2-3-9(11)18)15-16(26-27(21,22)23)14(20)13-10(19)5-8(17)6-12(13)25-15/h2-6,17-18,20H,1H3,(H,21,22,23)/p-1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.46E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of cow milk xanthine oxidase				J Nat Prod 51: 345-348 (1988) Article DOI: 10.1021/np50056a030 BindingDB Entry DOI: 10.7270/Q2DJ5FNN
					More data for this Ligand-Target Pair
Aldose reductase (Sus scrofa)	BDBM50292353 (CHEMBL471479 | Percicarin | Persicarin) Show SMILES COc1cc(ccc1O)-c1oc2cc(O)cc(=O)c2c(O)c1OS([O-])(=O)=O Show InChI InChI=1S/C16H12O10S/c1-24-11-4-7(2-3-9(11)18)15-16(26-27(21,22)23)14(20)13-10(19)5-8(17)6-12(13)25-15/h2-6,17-18,20H,1H3,(H,21,22,23)/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
Fukuyama University Curated by ChEMBL					Assay Description Inhibition of pig lens aldose reductase by spectrophotometry				J Nat Prod 59: 443-5 (1996) Article DOI: 10.1021/np9601622 BindingDB Entry DOI: 10.7270/Q29Z94X7
					More data for this Ligand-Target Pair