BDBM50247186 5-(2-(4-methoxyphenyl)prop-1-enyl)benzene-1,3-diol::CHEMBL474935

SMILES: COc1ccc(cc1)C(\C)=C\c1cc(O)cc(O)c1

InChI Key: InChIKey=UWAUANOAMSDSNK-YRNVUSSQSA-N

Data: 3 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 3 hits for monomerid = 50247186   

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-1 (COX-1) (Homo sapiens (Human))	BDBM50247186 (5-(2-(4-methoxyphenyl)prop-1-enyl)benzene-1,3-diol...) Show SMILES COc1ccc(cc1)C(\C)=C\c1cc(O)cc(O)c1 Show InChI InChI=1S/C16H16O3/c1-11(13-3-5-16(19-2)6-4-13)7-12-8-14(17)10-15(18)9-12/h3-10,17-18H,1-2H3/b11-7+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.24E+4	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of COX1				Bioorg Med Chem 17: 1044-54 (2009) Article DOI: 10.1016/j.bmc.2008.04.031 BindingDB Entry DOI: 10.7270/Q2WH2PRR
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50247186 (5-(2-(4-methoxyphenyl)prop-1-enyl)benzene-1,3-diol...) Show SMILES COc1ccc(cc1)C(\C)=C\c1cc(O)cc(O)c1 Show InChI InChI=1S/C16H16O3/c1-11(13-3-5-16(19-2)6-4-13)7-12-8-14(17)10-15(18)9-12/h3-10,17-18H,1-2H3/b11-7+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of human quinone reductase 2 expressed in Escherichia coli BL21(DE3) using N-methyldihydronicotinamide as co-substrate				Bioorg Med Chem 21: 6022-37 (2013) Article DOI: 10.1016/j.bmc.2013.07.037 BindingDB Entry DOI: 10.7270/Q21R6RX0
					More data for this Ligand-Target Pair
Cyclooxygenase (Homo sapiens (Human))	BDBM50247186 (5-(2-(4-methoxyphenyl)prop-1-enyl)benzene-1,3-diol...) Show SMILES COc1ccc(cc1)C(\C)=C\c1cc(O)cc(O)c1 Show InChI InChI=1S/C16H16O3/c1-11(13-3-5-16(19-2)6-4-13)7-12-8-14(17)10-15(18)9-12/h3-10,17-18H,1-2H3/b11-7+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of COX2				Bioorg Med Chem 17: 1044-54 (2009) Article DOI: 10.1016/j.bmc.2008.04.031 BindingDB Entry DOI: 10.7270/Q2WH2PRR
					More data for this Ligand-Target Pair