Compile Data Set for Download or QSAR

Found 37 hits with Last Name = 'aleshin' and Initial = 'a'   

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)	BDBM50316625 (4-benzhydrylnaphthalene-1,2-diol | CHEMBL1094496) Show SMILES Oc1cc(C(c2ccccc2)c2ccccc2)c2ccccc2c1O Show InChI InChI=1S/C23H18O2/c24-21-15-20(18-13-7-8-14-19(18)23(21)25)22(16-9-3-1-4-10-16)17-11-5-2-6-12-17/h1-15,22,24-25H	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	600	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)	BDBM50316625 (4-benzhydrylnaphthalene-1,2-diol | CHEMBL1094496) Show SMILES Oc1cc(C(c2ccccc2)c2ccccc2)c2ccccc2c1O Show InChI InChI=1S/C23H18O2/c24-21-15-20(18-13-7-8-14-19(18)23(21)25)22(16-9-3-1-4-10-16)17-11-5-2-6-12-17/h1-15,22,24-25H	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	600	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)	BDBM50316629 (1,2,3-trimethoxy-7-(3,4,5-trimethoxyphenyl)naphtha...) Show SMILES COc1cc(cc(OC)c1OC)-c1ccc2cc(OC)c(OC)c(OC)c2c1 Show InChI InChI=1S/C22H24O6/c1-23-17-11-15(12-18(24-2)21(17)27-5)13-7-8-14-10-19(25-3)22(28-6)20(26-4)16(14)9-13/h7-12H,1-6H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	900	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)	BDBM34138 (4,5-dibenzylbenzene-1,2-diol, 9) Show SMILES Oc1cc(Cc2ccccc2)c(Cc2ccccc2)cc1O Show InChI InChI=1S/C20H18O2/c21-19-13-17(11-15-7-3-1-4-8-15)18(14-20(19)22)12-16-9-5-2-6-10-16/h1-10,13-14,21-22H,11-12H2	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	900	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)	BDBM34138 (4,5-dibenzylbenzene-1,2-diol, 9) Show SMILES Oc1cc(Cc2ccccc2)c(Cc2ccccc2)cc1O Show InChI InChI=1S/C20H18O2/c21-19-13-17(11-15-7-3-1-4-8-15)18(14-20(19)22)12-16-9-5-2-6-10-16/h1-10,13-14,21-22H,11-12H2	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	900	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)	BDBM50316629 (1,2,3-trimethoxy-7-(3,4,5-trimethoxyphenyl)naphtha...) Show SMILES COc1cc(cc(OC)c1OC)-c1ccc2cc(OC)c(OC)c(OC)c2c1 Show InChI InChI=1S/C22H24O6/c1-23-17-11-15(12-18(24-2)21(17)27-5)13-7-8-14-10-19(25-3)22(28-6)20(26-4)16(14)9-13/h7-12H,1-6H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	900	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)	BDBM50316627 (4,4'-(1,2-phenylenebis(azan-1-yl-1-ylidene))bis(me...) Show SMILES Oc1ccc(\C=N\c2ccccc2\N=C\c2ccc(O)c(O)c2)cc1O Show InChI InChI=1S/C20H16N2O4/c23-17-7-5-13(9-19(17)25)11-21-15-3-1-2-4-16(15)22-12-14-6-8-18(24)20(26)10-14/h1-12,23-26H/b21-11+,22-12+	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20E+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)	BDBM50316627 (4,4'-(1,2-phenylenebis(azan-1-yl-1-ylidene))bis(me...) Show SMILES Oc1ccc(\C=N\c2ccccc2\N=C\c2ccc(O)c(O)c2)cc1O Show InChI InChI=1S/C20H16N2O4/c23-17-7-5-13(9-19(17)25)11-21-15-3-1-2-4-16(15)22-12-14-6-8-18(24)20(26)10-14/h1-12,23-26H/b21-11+,22-12+	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20E+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)	BDBM50316627 (4,4'-(1,2-phenylenebis(azan-1-yl-1-ylidene))bis(me...) Show SMILES Oc1ccc(\C=N\c2ccccc2\N=C\c2ccc(O)c(O)c2)cc1O Show InChI InChI=1S/C20H16N2O4/c23-17-7-5-13(9-19(17)25)11-21-15-3-1-2-4-16(15)22-12-14-6-8-18(24)20(26)10-14/h1-12,23-26H/b21-11+,22-12+	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.30E+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
Virokine/NFkB inhibitor (Vaccinia virus)	BDBM50316626 (2'-methoxy-1,1'-binaphthyl-2-ol | CHEMBL1094828) Show SMILES COc1ccc2ccccc2c1-c1c(O)ccc2ccccc12 |(12.2,-23.98,;10.87,-23.22,;9.53,-23.99,;9.54,-25.53,;8.21,-26.31,;6.87,-25.54,;5.54,-26.32,;4.21,-25.56,;4.2,-24.01,;5.53,-23.24,;6.87,-24,;8.2,-23.23,;8.2,-21.7,;9.54,-20.92,;10.87,-21.69,;9.53,-19.37,;8.19,-18.61,;6.86,-19.38,;5.52,-18.62,;4.19,-19.39,;4.19,-20.94,;5.53,-21.71,;6.86,-20.93,)| Show InChI InChI=1S/C21H16O2/c1-23-19-13-11-15-7-3-5-9-17(15)21(19)20-16-8-4-2-6-14(16)10-12-18(20)22/h2-13,22H,1H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.50E+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)	BDBM50316626 (2'-methoxy-1,1'-binaphthyl-2-ol | CHEMBL1094828) Show SMILES COc1ccc2ccccc2c1-c1c(O)ccc2ccccc12 |(12.2,-23.98,;10.87,-23.22,;9.53,-23.99,;9.54,-25.53,;8.21,-26.31,;6.87,-25.54,;5.54,-26.32,;4.21,-25.56,;4.2,-24.01,;5.53,-23.24,;6.87,-24,;8.2,-23.23,;8.2,-21.7,;9.54,-20.92,;10.87,-21.69,;9.53,-19.37,;8.19,-18.61,;6.86,-19.38,;5.52,-18.62,;4.19,-19.39,;4.19,-20.94,;5.53,-21.71,;6.86,-20.93,)| Show InChI InChI=1S/C21H16O2/c1-23-19-13-11-15-7-3-5-9-17(15)21(19)20-16-8-4-2-6-14(16)10-12-18(20)22/h2-13,22H,1H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.50E+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)	BDBM50316629 (1,2,3-trimethoxy-7-(3,4,5-trimethoxyphenyl)naphtha...) Show SMILES COc1cc(cc(OC)c1OC)-c1ccc2cc(OC)c(OC)c(OC)c2c1 Show InChI InChI=1S/C22H24O6/c1-23-17-11-15(12-18(24-2)21(17)27-5)13-7-8-14-10-19(25-3)22(28-6)20(26-4)16(14)9-13/h7-12H,1-6H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.60E+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
Virokine/NFkB inhibitor (Vaccinia virus)	BDBM50316628 (CHEMBL1098663 | N-((4-methoxyphenyl)(phenyl)methyl...) Show SMILES COc1ccc(cc1)C(=N\c1ccc(C)cc1)\c1ccccc1 Show InChI InChI=1S/C21H19NO/c1-16-8-12-19(13-9-16)22-21(17-6-4-3-5-7-17)18-10-14-20(23-2)15-11-18/h3-15H,1-2H3/b22-21+	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.70E+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
Virokine/NFkB inhibitor (Vaccinia virus)	BDBM50316628 (CHEMBL1098663 | N-((4-methoxyphenyl)(phenyl)methyl...) Show SMILES COc1ccc(cc1)C(=N\c1ccc(C)cc1)\c1ccccc1 Show InChI InChI=1S/C21H19NO/c1-16-8-12-19(13-9-16)22-21(17-6-4-3-5-7-17)18-10-14-20(23-2)15-11-18/h3-15H,1-2H3/b22-21+	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.70E+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)	BDBM50316624 (4-benzhydryl-2-methoxynaphthalen-1-ol | CHEMBL1098...) Show SMILES COc1cc(C(c2ccccc2)c2ccccc2)c2ccccc2c1O Show InChI InChI=1S/C24H20O2/c1-26-22-16-21(19-14-8-9-15-20(19)24(22)25)23(17-10-4-2-5-11-17)18-12-6-3-7-13-18/h2-16,23,25H,1H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.80E+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)	BDBM50316624 (4-benzhydryl-2-methoxynaphthalen-1-ol | CHEMBL1098...) Show SMILES COc1cc(C(c2ccccc2)c2ccccc2)c2ccccc2c1O Show InChI InChI=1S/C24H20O2/c1-26-22-16-21(19-14-8-9-15-20(19)24(22)25)23(17-10-4-2-5-11-17)18-12-6-3-7-13-18/h2-16,23,25H,1H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.80E+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)	BDBM34138 (4,5-dibenzylbenzene-1,2-diol, 9) Show SMILES Oc1cc(Cc2ccccc2)c(Cc2ccccc2)cc1O Show InChI InChI=1S/C20H18O2/c21-19-13-17(11-15-7-3-1-4-8-15)18(14-20(19)22)12-16-9-5-2-6-10-16/h1-10,13-14,21-22H,11-12H2	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.80E+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
Virokine/NFkB inhibitor (Vaccinia virus)	BDBM50316625 (4-benzhydrylnaphthalene-1,2-diol | CHEMBL1094496) Show SMILES Oc1cc(C(c2ccccc2)c2ccccc2)c2ccccc2c1O Show InChI InChI=1S/C23H18O2/c24-21-15-20(18-13-7-8-14-19(18)23(21)25)22(16-9-3-1-4-10-16)17-11-5-2-6-12-17/h1-15,22,24-25H	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.90E+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
Virokine/NFkB inhibitor (Vaccinia virus)	BDBM50316624 (4-benzhydryl-2-methoxynaphthalen-1-ol | CHEMBL1098...) Show SMILES COc1cc(C(c2ccccc2)c2ccccc2)c2ccccc2c1O Show InChI InChI=1S/C24H20O2/c1-26-22-16-21(19-14-8-9-15-20(19)24(22)25)23(17-10-4-2-5-11-17)18-12-6-3-7-13-18/h2-16,23,25H,1H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD 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
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
Virokine/NFkB inhibitor (Vaccinia virus)	BDBM50316623 ((N,N)-N,N'-(1,2-bis(3,4,5-trimethoxyphenyl)ethane-...) Show SMILES COc1cc(cc(OC)c1OC)\C(=N/c1ccccc1)\C(=N\c1ccccc1)\c1cc(OC)c(OC)c(OC)c1 Show InChI InChI=1S/C32H32N2O6/c1-35-25-17-21(18-26(36-2)31(25)39-5)29(33-23-13-9-7-10-14-23)30(34-24-15-11-8-12-16-24)22-19-27(37-3)32(40-6)28(20-22)38-4/h7-20H,1-6H3/b33-29+,34-30+	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.40E+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)	BDBM50316623 ((N,N)-N,N'-(1,2-bis(3,4,5-trimethoxyphenyl)ethane-...) Show SMILES COc1cc(cc(OC)c1OC)\C(=N/c1ccccc1)\C(=N\c1ccccc1)\c1cc(OC)c(OC)c(OC)c1 Show InChI InChI=1S/C32H32N2O6/c1-35-25-17-21(18-26(36-2)31(25)39-5)29(33-23-13-9-7-10-14-23)30(34-24-15-11-8-12-16-24)22-19-27(37-3)32(40-6)28(20-22)38-4/h7-20H,1-6H3/b33-29+,34-30+	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.40E+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)	BDBM50316623 ((N,N)-N,N'-(1,2-bis(3,4,5-trimethoxyphenyl)ethane-...) Show SMILES COc1cc(cc(OC)c1OC)\C(=N/c1ccccc1)\C(=N\c1ccccc1)\c1cc(OC)c(OC)c(OC)c1 Show InChI InChI=1S/C32H32N2O6/c1-35-25-17-21(18-26(36-2)31(25)39-5)29(33-23-13-9-7-10-14-23)30(34-24-15-11-8-12-16-24)22-19-27(37-3)32(40-6)28(20-22)38-4/h7-20H,1-6H3/b33-29+,34-30+	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.50E+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
Virokine/NFkB inhibitor (Vaccinia virus)	BDBM50316626 (2'-methoxy-1,1'-binaphthyl-2-ol | CHEMBL1094828) Show SMILES COc1ccc2ccccc2c1-c1c(O)ccc2ccccc12 |(12.2,-23.98,;10.87,-23.22,;9.53,-23.99,;9.54,-25.53,;8.21,-26.31,;6.87,-25.54,;5.54,-26.32,;4.21,-25.56,;4.2,-24.01,;5.53,-23.24,;6.87,-24,;8.2,-23.23,;8.2,-21.7,;9.54,-20.92,;10.87,-21.69,;9.53,-19.37,;8.19,-18.61,;6.86,-19.38,;5.52,-18.62,;4.19,-19.39,;4.19,-20.94,;5.53,-21.71,;6.86,-20.93,)| Show InChI InChI=1S/C21H16O2/c1-23-19-13-11-15-7-3-5-9-17(15)21(19)20-16-8-4-2-6-14(16)10-12-18(20)22/h2-13,22H,1H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.60E+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
Apoptosis regulator Bcl-2 (Homo sapiens (Human))	BDBM34138 (4,5-dibenzylbenzene-1,2-diol, 9) Show SMILES Oc1cc(Cc2ccccc2)c(Cc2ccccc2)cc1O Show InChI InChI=1S/C20H18O2/c21-19-13-17(11-15-7-3-1-4-8-15)18(14-20(19)22)12-16-9-5-2-6-10-16/h1-10,13-14,21-22H,11-12H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.70E+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-Bim peptide from human recombinant Bcl-2 expressed in Escherichia coli BL21 (DE3) by fluorescence polarization as...				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)	BDBM50316632 (2,6-dimethoxy-4-(4-methoxyphenethyl)phenol | CHEMB...) Show SMILES COc1ccc(CCc2cc(OC)c(O)c(OC)c2)cc1 Show InChI InChI=1S/C17H20O4/c1-19-14-8-6-12(7-9-14)4-5-13-10-15(20-2)17(18)16(11-13)21-3/h6-11,18H,4-5H2,1-3H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.00E+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)	BDBM50316632 (2,6-dimethoxy-4-(4-methoxyphenethyl)phenol | CHEMB...) Show SMILES COc1ccc(CCc2cc(OC)c(O)c(OC)c2)cc1 Show InChI InChI=1S/C17H20O4/c1-19-14-8-6-12(7-9-14)4-5-13-10-15(20-2)17(18)16(11-13)21-3/h6-11,18H,4-5H2,1-3H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.00E+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	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	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	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
Virokine/NFkB inhibitor (Vaccinia virus)	BDBM50316632 (2,6-dimethoxy-4-(4-methoxyphenethyl)phenol | CHEMB...) Show SMILES COc1ccc(CCc2cc(OC)c(O)c(OC)c2)cc1 Show InChI InChI=1S/C17H20O4/c1-19-14-8-6-12(7-9-14)4-5-13-10-15(20-2)17(18)16(11-13)21-3/h6-11,18H,4-5H2,1-3H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.50E+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
Bcl-2-like protein 1 (Homo sapiens (Human))	BDBM34138 (4,5-dibenzylbenzene-1,2-diol, 9) Show SMILES Oc1cc(Cc2ccccc2)c(Cc2ccccc2)cc1O Show InChI InChI=1S/C20H18O2/c21-19-13-17(11-15-7-3-1-4-8-15)18(14-20(19)22)12-16-9-5-2-6-10-16/h1-10,13-14,21-22H,11-12H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.50E+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 human recombinant Bcl-XL expressed in Escherichia coli BL21 (DE3) by fluorescence polarization a...				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)	BDBM50316630 (4,4',4''-methanetriyltris(2-methoxyphenol) | CHEMB...) Show SMILES COc1cc(ccc1O)C(c1ccc(O)c(OC)c1)c1ccc(O)c(OC)c1 Show InChI InChI=1S/C22H22O6/c1-26-19-10-13(4-7-16(19)23)22(14-5-8-17(24)20(11-14)27-2)15-6-9-18(25)21(12-15)28-3/h4-12,22-25H,1-3H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.80E+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)	BDBM50316630 (4,4',4''-methanetriyltris(2-methoxyphenol) | CHEMB...) Show SMILES COc1cc(ccc1O)C(c1ccc(O)c(OC)c1)c1ccc(O)c(OC)c1 Show InChI InChI=1S/C22H22O6/c1-26-19-10-13(4-7-16(19)23)22(14-5-8-17(24)20(11-14)27-2)15-6-9-18(25)21(12-15)28-3/h4-12,22-25H,1-3H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.80E+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)	BDBM50316630 (4,4',4''-methanetriyltris(2-methoxyphenol) | CHEMB...) Show SMILES COc1cc(ccc1O)C(c1ccc(O)c(OC)c1)c1ccc(O)c(OC)c1 Show InChI InChI=1S/C22H22O6/c1-26-19-10-13(4-7-16(19)23)22(14-5-8-17(24)20(11-14)27-2)15-6-9-18(25)21(12-15)28-3/h4-12,22-25H,1-3H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD 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
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
Virokine/NFkB inhibitor (Vaccinia virus)	BDBM23926 ((E)-resveratrol | 5-[(E)-2-(4-hydroxyphenyl)etheny...) Show SMILES Oc1ccc(\C=C\c2cc(O)cc(O)c2)cc1 Show InChI InChI=1S/C14H12O3/c15-12-5-3-10(4-6-12)1-2-11-7-13(16)9-14(17)8-11/h1-9,15-17H/b2-1+	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	2.19E+4	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)	BDBM23926 ((E)-resveratrol | 5-[(E)-2-(4-hydroxyphenyl)etheny...) Show SMILES Oc1ccc(\C=C\c2cc(O)cc(O)c2)cc1 Show InChI InChI=1S/C14H12O3/c15-12-5-3-10(4-6-12)1-2-11-7-13(16)9-14(17)8-11/h1-9,15-17H/b2-1+	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	2.19E+4	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
Bcl-2-like protein 1 (Homo sapiens (Human))	BDBM23926 ((E)-resveratrol | 5-[(E)-2-(4-hydroxyphenyl)etheny...) Show SMILES Oc1ccc(\C=C\c2cc(O)cc(O)c2)cc1 Show InChI InChI=1S/C14H12O3/c15-12-5-3-10(4-6-12)1-2-11-7-13(16)9-14(17)8-11/h1-9,15-17H/b2-1+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	1.90E+5	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 human recombinant Bcl-XL expressed in Escherichia coli BL21 (DE3) by fluorescence polarization a...				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