Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Virokine/NFkB inhibitor' and Ligand = 'BDBM50316631'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Virokine/NFkB inhibitor (Vaccinia virus)	BDBM50316631 (1,2,3-trimethoxy-5-(1-(4-methoxyphenyl)ethyl)benze...) Show SMILES COc1ccc(cc1)C(C)c1cc(OC)c(OC)c(OC)c1 Show InChI InChI=1S/C18H22O4/c1-12(13-6-8-15(19-2)9-7-13)14-10-16(20-3)18(22-5)17(11-14)21-4/h6-12H,1-5H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Institute for Medical Research Curated by ChEMBL					Assay Description Displacement of FITC-conjugated BH3-Bak peptide from 0.5 uM Vaccinia virus recombinant N1L expressed in Escherichia coli BL21 (DE3) by fluorescence p...				J Med Chem 53: 3899-906 (2010) Article DOI: 10.1021/jm901446n BindingDB Entry DOI: 10.7270/Q2NZ87SD
					More data for this Ligand-Target Pair
Virokine/NFkB inhibitor (Vaccinia virus)	BDBM50316631 (1,2,3-trimethoxy-5-(1-(4-methoxyphenyl)ethyl)benze...) Show SMILES COc1ccc(cc1)C(C)c1cc(OC)c(OC)c(OC)c1 Show InChI InChI=1S/C18H22O4/c1-12(13-6-8-15(19-2)9-7-13)14-10-16(20-3)18(22-5)17(11-14)21-4/h6-12H,1-5H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Institute for Medical Research Curated by ChEMBL					Assay Description Displacement of FITC-conjugated BH3-Bak peptide from Vaccinia virus recombinant N1L expressed in Escherichia coli BL21 (DE3) by fluorescence polariza...				J Med Chem 53: 3899-906 (2010) Article DOI: 10.1021/jm901446n BindingDB Entry DOI: 10.7270/Q2NZ87SD
					More data for this Ligand-Target Pair
Virokine/NFkB inhibitor (Vaccinia virus)	BDBM50316631 (1,2,3-trimethoxy-5-(1-(4-methoxyphenyl)ethyl)benze...) Show SMILES COc1ccc(cc1)C(C)c1cc(OC)c(OC)c(OC)c1 Show InChI InChI=1S/C18H22O4/c1-12(13-6-8-15(19-2)9-7-13)14-10-16(20-3)18(22-5)17(11-14)21-4/h6-12H,1-5H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Institute for Medical Research Curated by ChEMBL					Assay Description Displacement of FITC-conjugated BH3-Bak peptide from 1 uM Vaccinia virus recombinant N1L expressed in Escherichia coli BL21 (DE3) by fluorescence pol...				J Med Chem 53: 3899-906 (2010) Article DOI: 10.1021/jm901446n BindingDB Entry DOI: 10.7270/Q2NZ87SD
					More data for this Ligand-Target Pair