BDBM50305802 3-(benzo[d][1,3]dioxol-5-yl)-4-phenylfuran-2,5-dione::CHEMBL603434

SMILES: O=C1OC(=O)C(=C1c1ccccc1)c1ccc2OCOc2c1

InChI Key: InChIKey=IMHGOAWBSJVILI-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 = 50305802   

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
Cyclooxygenase (Homo sapiens (Human))	BDBM50305802 (3-(benzo[d][1,3]dioxol-5-yl)-4-phenylfuran-2,5-dio...) Show SMILES O=C1OC(=O)C(=C1c1ccccc1)c1ccc2OCOc2c1 |c:5| Show InChI InChI=1S/C17H10O5/c18-16-14(10-4-2-1-3-5-10)15(17(19)22-16)11-6-7-12-13(8-11)21-9-20-12/h1-8H,9H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.85E+4	n/a	n/a	n/a	n/a	n/a	n/a
Kyung Hee University Curated by ChEMBL					Assay Description Inhibition of COX2 assessed as PGF2alpha level by EIA				Bioorg Med Chem Lett 20: 734-7 (2010) Article DOI: 10.1016/j.bmcl.2009.11.067 BindingDB Entry DOI: 10.7270/Q2Z31ZQQ
					More data for this Ligand-Target Pair