BDBM50141525 (E)-1-(2,5-Dimethoxy-phenyl)-3-(2-methoxy-5-thiophen-2-yl-phenyl)-propenone::CHEMBL449083

SMILES: COc1ccc(OC)c(c1)C(=O)\C=C\c1cc(ccc1OC)-c1cccs1

InChI Key: InChIKey=QZTODIFDCJATHT-RMKNXTFCSA-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 = 50141525   

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
Tumor necrosis factor receptor R1 (Homo sapiens (Human))	BDBM50141525 ((E)-1-(2,5-Dimethoxy-phenyl)-3-(2-methoxy-5-thioph...) Show SMILES COc1ccc(OC)c(c1)C(=O)\C=C\c1cc(ccc1OC)-c1cccs1 Show InChI InChI=1S/C22H20O4S/c1-24-17-8-11-21(26-3)18(14-17)19(23)9-6-15-13-16(7-10-20(15)25-2)22-5-4-12-27-22/h4-14H,1-3H3/b9-6+	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	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
AtheroGenics, Inc. Curated by ChEMBL					Assay Description Inhibition of TNF-alpha-induced VCAM-1 expression				Bioorg Med Chem Lett 14: 1513-7 (2004) Article DOI: 10.1016/j.bmcl.2004.01.021 BindingDB Entry DOI: 10.7270/Q2028QZK
					More data for this Ligand-Target Pair