BDBM50322614 CHEMBL1173450::Resveratrol Potassium4,-Sulfate

SMILES: Oc1cc(O)cc(\C=C\c2ccc(OS([O-])(=O)=O)cc2)c1

InChI Key: InChIKey=KOTTWDFKZULRPN-OWOJBTEDSA-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 = 50322614   

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
Prostaglandin G/H synthase (cyclooxygenase) (Ovis aries (Sheep))	BDBM50322614 (CHEMBL1173450 | Resveratrol Potassium4,-Sulfate) Show SMILES Oc1cc(O)cc(\C=C\c2ccc(OS([O-])(=O)=O)cc2)c1 Show InChI InChI=1S/C14H12O6S/c15-12-7-11(8-13(16)9-12)2-1-10-3-5-14(6-4-10)20-21(17,18)19/h1-9,15-16H,(H,17,18,19)/p-1/b2-1+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.55E+3	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of sheep seminal vesicles COX1 assessed as PGE2 production after 10 mins by ELISA				J Med Chem 53: 5033-43 (2010) Article DOI: 10.1021/jm100274c BindingDB Entry DOI: 10.7270/Q2VD6ZNW
					More data for this Ligand-Target Pair
Cyclooxygenase (Homo sapiens (Human))	BDBM50322614 (CHEMBL1173450 | Resveratrol Potassium4,-Sulfate) Show SMILES Oc1cc(O)cc(\C=C\c2ccc(OS([O-])(=O)=O)cc2)c1 Show InChI InChI=1S/C14H12O6S/c15-12-7-11(8-13(16)9-12)2-1-10-3-5-14(6-4-10)20-21(17,18)19/h1-9,15-16H,(H,17,18,19)/p-1/b2-1+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.95E+3	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of human recombinant COX2 assessed as PGE2 production after 10 mins by ELISA				J Med Chem 53: 5033-43 (2010) Article DOI: 10.1021/jm100274c BindingDB Entry DOI: 10.7270/Q2VD6ZNW
					More data for this Ligand-Target Pair