Compile Data Set for Download or QSAR

Found 52 hits Enz. Inhib. hit(s) with all data for entry = 6015   

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
DNA polymerase lambda (Homo sapiens (Human))	BDBM104089 ((Z)-5-(3-Nitro-4-(o-tolylthio)benzylidene)-2-thiox...) Show SMILES Cc1ccccc1Sc1ccc(C=C2SC(S)=NC2=O)cc1[N+]([O-])=O |w:12.12,c:17| Show InChI InChI=1S/C17H12N2O3S3/c1-10-4-2-3-5-13(10)24-14-7-6-11(8-12(14)19(21)22)9-15-16(20)18-17(23)25-15/h2-9H,1H3,(H,18,20,23)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.90E+3	n/a	n/a	n/a	n/a	7.5	n/a
University of Konstanz					Assay Description Pol λ reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.5, 1.5mM MgCl2, 5% (v/v) glycerol, 1mM DTT, 250nM purified rec...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase lambda (Homo sapiens (Human))	BDBM104097 ((Z)-5-(2,4-Bis(p-tolylthio)benzylidene)-2-thioxoth...) Show SMILES Cc1ccc(Sc2ccc(C=C3SC(S)=NC3=O)c(Sc3ccc(C)cc3)c2)cc1 |w:10.9,c:14| Show InChI InChI=1S/C24H19NOS4/c1-15-3-8-18(9-4-15)28-20-12-7-17(13-22-23(26)25-24(27)30-22)21(14-20)29-19-10-5-16(2)6-11-19/h3-14H,1-2H3,(H,25,26,27)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	7.5	n/a
University of Konstanz					Assay Description Pol λ reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.5, 1.5mM MgCl2, 5% (v/v) glycerol, 1mM DTT, 250nM purified rec...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase lambda (Homo sapiens (Human))	BDBM104093 ((Z)-5-(3-Bromo-4-((3-fluoro-4-methylphenyl)thio)be...) Show SMILES Cc1ccc(Sc2ccc(C=C3SC(S)=NC3=O)cc2Br)cc1F |w:10.9,c:14| Show InChI InChI=1S/C17H11BrFNOS3/c1-9-2-4-11(8-13(9)19)23-14-5-3-10(6-12(14)18)7-15-16(21)20-17(22)24-15/h2-8H,1H3,(H,20,21,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	7.5	n/a
University of Konstanz					Assay Description Pol λ reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.5, 1.5mM MgCl2, 5% (v/v) glycerol, 1mM DTT, 250nM purified rec...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase lambda (Homo sapiens (Human))	BDBM104079 ((Z)-5-(3-Chloro-4-(p-tolylthio)benzylidene)-2-thio...) Show SMILES Cc1ccc(Sc2ccc(C=C3SC(S)=NC3=O)cc2Cl)cc1 |w:10.9,c:14| Show InChI InChI=1S/C17H12ClNOS3/c1-10-2-5-12(6-3-10)22-14-7-4-11(8-13(14)18)9-15-16(20)19-17(21)23-15/h2-9H,1H3,(H,19,20,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.70E+3	n/a	n/a	n/a	n/a	7.5	n/a
University of Konstanz					Assay Description Pol λ reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.5, 1.5mM MgCl2, 5% (v/v) glycerol, 1mM DTT, 250nM purified rec...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase lambda (Homo sapiens (Human))	BDBM104067 (DNA polymerase inhibitor 1) Show SMILES Cc1ccc(Sc2ccc(C=C3SC(S)=NC3=O)cc2[N+]([O-])=O)cc1 |w:10.9,c:14| Show InChI InChI=1S/C17H12N2O3S3/c1-10-2-5-12(6-3-10)24-14-7-4-11(8-13(14)19(21)22)9-15-16(20)18-17(23)25-15/h2-9H,1H3,(H,18,20,23)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.90E+3	n/a	n/a	n/a	n/a	7.5	n/a
University of Konstanz					Assay Description Pol λ reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.5, 1.5mM MgCl2, 5% (v/v) glycerol, 1mM DTT, 250nM purified rec...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase lambda (Homo sapiens (Human))	BDBM104088 ((Z)-5-(3-Nitro-4-(m-tolylthio)benzylidene)-2-thiox...) Show SMILES Cc1cccc(Sc2ccc(C=C3SC(S)=NC3=O)cc2[N+]([O-])=O)c1 |w:11.10,c:15| Show InChI InChI=1S/C17H12N2O3S3/c1-10-3-2-4-12(7-10)24-14-6-5-11(8-13(14)19(21)22)9-15-16(20)18-17(23)25-15/h2-9H,1H3,(H,18,20,23)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.00E+3	n/a	n/a	n/a	n/a	7.5	n/a
University of Konstanz					Assay Description Pol λ reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.5, 1.5mM MgCl2, 5% (v/v) glycerol, 1mM DTT, 250nM purified rec...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase lambda (Homo sapiens (Human))	BDBM104077 ((Z)-2-Thioxo-5-(4-(p-tolylthio)benzylidene)thiazol...) Show SMILES Cc1ccc(Sc2ccc(C=C3SC(S)=NC3=O)cc2)cc1 |w:10.9,c:14| Show InChI InChI=1S/C17H13NOS3/c1-11-2-6-13(7-3-11)21-14-8-4-12(5-9-14)10-15-16(19)18-17(20)22-15/h2-10H,1H3,(H,18,19,20)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<1.00E+4	n/a	n/a	n/a	n/a	7.5	n/a
University of Konstanz					Assay Description Pol λ reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.5, 1.5mM MgCl2, 5% (v/v) glycerol, 1mM DTT, 250nM purified rec...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase lambda (Homo sapiens (Human))	BDBM104094 (23 (Z)-2-Thioxo-5-(4-(o-tolylthio)benzylidene)thia...) Show SMILES Cc1ccccc1Sc1ccc(C=C2SC(S)=NC2=O)cc1 |w:12.12,c:17| Show InChI InChI=1S/C17H13NOS3/c1-11-4-2-3-5-14(11)21-13-8-6-12(7-9-13)10-15-16(19)18-17(20)22-15/h2-10H,1H3,(H,18,19,20)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<1.00E+4	n/a	n/a	n/a	n/a	7.5	n/a
University of Konstanz					Assay Description Pol λ reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.5, 1.5mM MgCl2, 5% (v/v) glycerol, 1mM DTT, 250nM purified rec...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase lambda (Homo sapiens (Human))	BDBM104096 ((Z)-2-Thioxo-5-(4-(o-tolylthio)-3- (trifluoromethy...) Show SMILES Cc1ccccc1Sc1ccc(C=C2SC(S)=NC2=O)cc1C(F)(F)F |w:12.12,c:17| Show InChI InChI=1S/C18H12F3NOS3/c1-10-4-2-3-5-13(10)25-14-7-6-11(8-12(14)18(19,20)21)9-15-16(23)22-17(24)26-15/h2-9H,1H3,(H,22,23,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<1.00E+4	n/a	n/a	n/a	n/a	7.5	n/a
University of Konstanz					Assay Description Pol λ reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.5, 1.5mM MgCl2, 5% (v/v) glycerol, 1mM DTT, 250nM purified rec...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase lambda (Homo sapiens (Human))	BDBM104095 ((Z)-5-(3-Fluoro-4-(o-tolylthio)benzylidene)-2-thio...) Show SMILES Cc1ccccc1Sc1ccc(C=C2SC(S)=NC2=O)cc1F |w:12.12,c:17| Show InChI InChI=1S/C17H12FNOS3/c1-10-4-2-3-5-13(10)22-14-7-6-11(8-12(14)18)9-15-16(20)19-17(21)23-15/h2-9H,1H3,(H,19,20,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<1.00E+4	n/a	n/a	n/a	n/a	7.5	n/a
University of Konstanz					Assay Description Pol λ reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.5, 1.5mM MgCl2, 5% (v/v) glycerol, 1mM DTT, 250nM purified rec...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase lambda (Homo sapiens (Human))	BDBM104074 ((Z)-5-(1-(3-Nitro-4-(p-tolylthio)phenyl)ethylidene...) Show SMILES Cc1ccc(Sc2ccc(cc2[N+]([O-])=O)C(=C)c2sc(S)nc2O)cc1 Show InChI InChI=1S/C18H14N2O3S3/c1-10-3-6-13(7-4-10)25-15-8-5-12(9-14(15)20(22)23)11(2)16-17(21)19-18(24)26-16/h3-9,21H,2H2,1H3,(H,19,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<1.00E+4	n/a	n/a	n/a	n/a	7.5	n/a
University of Konstanz					Assay Description Pol λ reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.5, 1.5mM MgCl2, 5% (v/v) glycerol, 1mM DTT, 250nM purified rec...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase lambda (Homo sapiens (Human))	BDBM104069 ((Z)-5-(3-Nitro-4-(p-tolylthio)benzylidene)thiazoli...) Show SMILES Cc1ccc(Sc2ccc(C=C3SC(O)=NC3=O)cc2[N+]([O-])=O)cc1 |w:10.9,c:14| Show InChI InChI=1S/C17H12N2O4S2/c1-10-2-5-12(6-3-10)24-14-7-4-11(8-13(14)19(22)23)9-15-16(20)18-17(21)25-15/h2-9H,1H3,(H,18,20,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<1.00E+4	n/a	n/a	n/a	n/a	7.5	n/a
University of Konstanz					Assay Description Pol λ reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.5, 1.5mM MgCl2, 5% (v/v) glycerol, 1mM DTT, 250nM purified rec...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase lambda (Homo sapiens (Human))	BDBM104068 ((Z)-5-(4-(Cyclohexylthio)-3-nitrobenzylidene)-2-th...) Show SMILES [O-][N+](=O)c1cc(C=C2SC(S)=NC2=O)ccc1SC1CCCCC1 |w:6.5,c:10| Show InChI InChI=1S/C16H16N2O3S3/c19-15-14(24-16(22)17-15)9-10-6-7-13(12(8-10)18(20)21)23-11-4-2-1-3-5-11/h6-9,11H,1-5H2,(H,17,19,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<1.00E+4	n/a	n/a	n/a	n/a	7.5	n/a
University of Konstanz					Assay Description Pol λ reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.5, 1.5mM MgCl2, 5% (v/v) glycerol, 1mM DTT, 250nM purified rec...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase lambda (Homo sapiens (Human))	BDBM104098 ((Z)-5-((4-Bromo-5-(p-tolylthio)thiophen-2-yl)methy...) Show SMILES Cc1ccc(Sc2sc(C=C3SC(S)=NC3=O)cc2Br)cc1 |w:9.8,c:13| Show InChI InChI=1S/C15H10BrNOS4/c1-8-2-4-9(5-3-8)20-14-11(16)6-10(21-14)7-12-13(18)17-15(19)22-12/h2-7H,1H3,(H,17,18,19)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	<1.00E+4	n/a	n/a	n/a	n/a	7.5	n/a
University of Konstanz					Assay Description Pol λ reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.5, 1.5mM MgCl2, 5% (v/v) glycerol, 1mM DTT, 250nM purified rec...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase lambda (Homo sapiens (Human))	BDBM104078 ((Z)-5-(3-Fluoro-4-(p-tolylthio)benzylidene)-2-thio...) Show SMILES Cc1ccc(Sc2ccc(C=C3SC(S)=NC3=O)cc2F)cc1 |w:10.9,c:14| Show InChI InChI=1S/C17H12FNOS3/c1-10-2-5-12(6-3-10)22-14-7-4-11(8-13(14)18)9-15-16(20)19-17(21)23-15/h2-9H,1H3,(H,19,20,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<1.00E+4	n/a	n/a	n/a	n/a	7.5	n/a
University of Konstanz					Assay Description Pol λ reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.5, 1.5mM MgCl2, 5% (v/v) glycerol, 1mM DTT, 250nM purified rec...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase lambda (Homo sapiens (Human))	BDBM104080 ((Z)-5-(3-Bromo-4-(p-tolylthio)benzylidene)-2-thiox...) Show SMILES Cc1ccc(Sc2ccc(C=C3SC(S)=NC3=O)cc2Br)cc1 |w:10.9,c:14| Show InChI InChI=1S/C17H12BrNOS3/c1-10-2-5-12(6-3-10)22-14-7-4-11(8-13(14)18)9-15-16(20)19-17(21)23-15/h2-9H,1H3,(H,19,20,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<1.00E+4	n/a	n/a	n/a	n/a	7.5	n/a
University of Konstanz					Assay Description Pol λ reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.5, 1.5mM MgCl2, 5% (v/v) glycerol, 1mM DTT, 250nM purified rec...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase lambda (Homo sapiens (Human))	BDBM104091 ((Z)-5-(4-(Naphthalen-2-ylthio)-3-nitrobenzylidene)...) Show SMILES [O-][N+](=O)c1cc(C=C2SC(S)=NC2=O)ccc1Sc1ccc2ccccc2c1 |w:6.5,c:10| Show InChI InChI=1S/C20H12N2O3S3/c23-19-18(28-20(26)21-19)10-12-5-8-17(16(9-12)22(24)25)27-15-7-6-13-3-1-2-4-14(13)11-15/h1-11H,(H,21,23,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<1.00E+4	n/a	n/a	n/a	n/a	7.5	n/a
University of Konstanz					Assay Description Pol λ reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.5, 1.5mM MgCl2, 5% (v/v) glycerol, 1mM DTT, 250nM purified rec...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase lambda (Homo sapiens (Human))	BDBM104090 ((Z)-5-(4-((3,5-Dimethylphenyl)thio)-3-nitrobenzyli...) Show SMILES Cc1cc(C)cc(Sc2ccc(C=C3SC(S)=NC3=O)cc2[N+]([O-])=O)c1 |w:12.11,c:16| Show InChI InChI=1S/C18H14N2O3S3/c1-10-5-11(2)7-13(6-10)25-15-4-3-12(8-14(15)20(22)23)9-16-17(21)19-18(24)26-16/h3-9H,1-2H3,(H,19,21,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<1.00E+4	n/a	n/a	n/a	n/a	7.5	n/a
University of Konstanz					Assay Description Pol λ reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.5, 1.5mM MgCl2, 5% (v/v) glycerol, 1mM DTT, 250nM purified rec...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase lambda (Homo sapiens (Human))	BDBM104087 ((Z)-5-(3-Nitro-4-((2,3,5,6-tetrafluoro-4-(trifluor...) Show SMILES [O-][N+](=O)c1cc(C=C2SC(S)=NC2=O)ccc1Sc1c(F)c(F)c(c(F)c1F)C(F)(F)F |w:6.5,c:10| Show InChI InChI=1S/C17H5F7N2O3S3/c18-10-9(17(22,23)24)11(19)13(21)14(12(10)20)31-7-2-1-5(3-6(7)26(28)29)4-8-15(27)25-16(30)32-8/h1-4H,(H,25,27,30)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<1.00E+4	n/a	n/a	n/a	n/a	7.5	n/a
University of Konstanz					Assay Description Pol λ reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.5, 1.5mM MgCl2, 5% (v/v) glycerol, 1mM DTT, 250nM purified rec...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase lambda (Homo sapiens (Human))	BDBM104086 ((Z)-5-(4-((3-Fluoro-4-methylphenyl)thio)-3-nitrobe...) Show SMILES Cc1ccc(Sc2ccc(C=C3SC(S)=NC3=O)cc2[N+]([O-])=O)cc1F |w:10.9,c:14| Show InChI InChI=1S/C17H11FN2O3S3/c1-9-2-4-11(8-12(9)18)25-14-5-3-10(6-13(14)20(22)23)7-15-16(21)19-17(24)26-15/h2-8H,1H3,(H,19,21,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<1.00E+4	n/a	n/a	n/a	n/a	7.5	n/a
University of Konstanz					Assay Description Pol λ reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.5, 1.5mM MgCl2, 5% (v/v) glycerol, 1mM DTT, 250nM purified rec...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase lambda (Homo sapiens (Human))	BDBM104084 ((Z)-5-(3-Nitro-4-((4-(trifluoromethyl)phenyl)thio)...) Show SMILES [O-][N+](=O)c1cc(C=C2SC(S)=NC2=O)ccc1Sc1ccc(cc1)C(F)(F)F |w:6.5,c:10| Show InChI InChI=1S/C17H9F3N2O3S3/c18-17(19,20)10-2-4-11(5-3-10)27-13-6-1-9(7-12(13)22(24)25)8-14-15(23)21-16(26)28-14/h1-8H,(H,21,23,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<1.00E+4	n/a	n/a	n/a	n/a	7.5	n/a
University of Konstanz					Assay Description Pol λ reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.5, 1.5mM MgCl2, 5% (v/v) glycerol, 1mM DTT, 250nM purified rec...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase lambda (Homo sapiens (Human))	BDBM104083 ((Z)-5-(4-((4-Ethylphenyl)thio)-3-nitrobenzylidene)...) Show SMILES CCc1ccc(Sc2ccc(C=C3SC(S)=NC3=O)cc2[N+]([O-])=O)cc1 |w:11.10,c:15| Show InChI InChI=1S/C18H14N2O3S3/c1-2-11-3-6-13(7-4-11)25-15-8-5-12(9-14(15)20(22)23)10-16-17(21)19-18(24)26-16/h3-10H,2H2,1H3,(H,19,21,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<1.00E+4	n/a	n/a	n/a	n/a	7.5	n/a
University of Konstanz					Assay Description Pol λ reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.5, 1.5mM MgCl2, 5% (v/v) glycerol, 1mM DTT, 250nM purified rec...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase lambda (Homo sapiens (Human))	BDBM104082 ((Z)-5-((4-Oxo-2-thioxothiazolidin-5-ylidene)methyl...) Show SMILES Cc1ccc(Sc2ccc(C=C3SC(S)=NC3=O)cc2C#N)cc1 |w:10.9,c:14| Show InChI InChI=1S/C18H12N2OS3/c1-11-2-5-14(6-3-11)23-15-7-4-12(8-13(15)10-19)9-16-17(21)20-18(22)24-16/h2-9H,1H3,(H,20,21,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<1.00E+4	n/a	n/a	n/a	n/a	7.5	n/a
University of Konstanz					Assay Description Pol λ reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.5, 1.5mM MgCl2, 5% (v/v) glycerol, 1mM DTT, 250nM purified rec...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase lambda (Homo sapiens (Human))	BDBM104081 ((Z)-2-Thioxo-5-(4-(p-tolylthio)-3- (trifluoromethy...) Show SMILES Cc1ccc(Sc2ccc(C=C3SC(S)=NC3=O)cc2C(F)(F)F)cc1 |w:10.9,c:14| Show InChI InChI=1S/C18H12F3NOS3/c1-10-2-5-12(6-3-10)25-14-7-4-11(8-13(14)18(19,20)21)9-15-16(23)22-17(24)26-15/h2-9H,1H3,(H,22,23,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<1.00E+4	n/a	n/a	n/a	n/a	7.5	n/a
University of Konstanz					Assay Description Pol λ reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.5, 1.5mM MgCl2, 5% (v/v) glycerol, 1mM DTT, 250nM purified rec...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase beta (Homo sapiens (Human))	BDBM104089 ((Z)-5-(3-Nitro-4-(o-tolylthio)benzylidene)-2-thiox...) Show SMILES Cc1ccccc1Sc1ccc(C=C2SC(S)=NC2=O)cc1[N+]([O-])=O |w:12.12,c:17| Show InChI InChI=1S/C17H12N2O3S3/c1-10-4-2-3-5-13(10)24-14-7-6-11(8-12(14)19(21)22)9-15-16(20)18-17(23)25-15/h2-9H,1H3,(H,18,20,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.82E+4	n/a	n/a	n/a	n/a	7.9	n/a
University of Konstanz					Assay Description Pol β reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.9, 20mM KCl, 5% (v/v) glycerol, 1mM DTT, 2mM MnCl2, 250nM puri...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase lambda (Homo sapiens (Human))	BDBM104076 ((Z)-5-(3-Nitro-4-tosylbenzylidene)-2-thioxothiazol...) Show SMILES Cc1ccc(cc1)S(=O)(=O)c1ccc(C=C2SC(S)=NC2=O)cc1[N+]([O-])=O |w:14.14,c:19| Show InChI InChI=1S/C17H12N2O5S3/c1-10-2-5-12(6-3-10)27(23,24)15-7-4-11(8-13(15)19(21)22)9-14-16(20)18-17(25)26-14/h2-9H,1H3,(H,18,20,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<2.00E+4	n/a	n/a	n/a	n/a	7.5	n/a
University of Konstanz					Assay Description Pol λ reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.5, 1.5mM MgCl2, 5% (v/v) glycerol, 1mM DTT, 250nM purified rec...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase lambda (Homo sapiens (Human))	BDBM104085 ((Z)-5-(3-Nitro-4-((4-(trifluoromethoxy)phenyl)thio...) Show SMILES [O-][N+](=O)c1cc(C=C2SC(S)=NC2=O)ccc1Sc1ccc(OC(F)(F)F)cc1 |w:6.5,c:10| Show InChI InChI=1S/C17H9F3N2O4S3/c18-17(19,20)26-10-2-4-11(5-3-10)28-13-6-1-9(7-12(13)22(24)25)8-14-15(23)21-16(27)29-14/h1-8H,(H,21,23,27)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<2.00E+4	n/a	n/a	n/a	n/a	7.5	n/a
University of Konstanz					Assay Description Pol λ reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.5, 1.5mM MgCl2, 5% (v/v) glycerol, 1mM DTT, 250nM purified rec...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase lambda (Homo sapiens (Human))	BDBM104092 ((Z)-5-(4-(Cyclopentylthio)-3-nitrobenzylidene)-2-t...) Show SMILES [O-][N+](=O)c1cc(C=C2SC(S)=NC2=O)ccc1SC1CCCC1 |w:6.5,c:10| Show InChI InChI=1S/C15H14N2O3S3/c18-14-13(23-15(21)16-14)8-9-5-6-12(11(7-9)17(19)20)22-10-3-1-2-4-10/h5-8,10H,1-4H2,(H,16,18,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<2.00E+4	n/a	n/a	n/a	n/a	7.5	n/a
University of Konstanz					Assay Description Pol λ reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.5, 1.5mM MgCl2, 5% (v/v) glycerol, 1mM DTT, 250nM purified rec...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase beta (Homo sapiens (Human))	BDBM104081 ((Z)-2-Thioxo-5-(4-(p-tolylthio)-3- (trifluoromethy...) Show SMILES Cc1ccc(Sc2ccc(C=C3SC(S)=NC3=O)cc2C(F)(F)F)cc1 |w:10.9,c:14| Show InChI InChI=1S/C18H12F3NOS3/c1-10-2-5-12(6-3-10)25-14-7-4-11(8-13(14)18(19,20)21)9-15-16(23)22-17(24)26-15/h2-9H,1H3,(H,22,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.81E+4	n/a	n/a	n/a	n/a	7.9	n/a
University of Konstanz					Assay Description Pol β reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.9, 20mM KCl, 5% (v/v) glycerol, 1mM DTT, 2mM MnCl2, 250nM puri...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase beta (Homo sapiens (Human))	BDBM104088 ((Z)-5-(3-Nitro-4-(m-tolylthio)benzylidene)-2-thiox...) Show SMILES Cc1cccc(Sc2ccc(C=C3SC(S)=NC3=O)cc2[N+]([O-])=O)c1 |w:11.10,c:15| Show InChI InChI=1S/C17H12N2O3S3/c1-10-3-2-4-12(7-10)24-14-6-5-11(8-13(14)19(21)22)9-15-16(20)18-17(23)25-15/h2-9H,1H3,(H,18,20,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.98E+4	n/a	n/a	n/a	n/a	7.9	n/a
University of Konstanz					Assay Description Pol β reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.9, 20mM KCl, 5% (v/v) glycerol, 1mM DTT, 2mM MnCl2, 250nM puri...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase beta (Homo sapiens (Human))	BDBM104078 ((Z)-5-(3-Fluoro-4-(p-tolylthio)benzylidene)-2-thio...) Show SMILES Cc1ccc(Sc2ccc(C=C3SC(S)=NC3=O)cc2F)cc1 |w:10.9,c:14| Show InChI InChI=1S/C17H12FNOS3/c1-10-2-5-12(6-3-10)22-14-7-4-11(8-13(14)18)9-15-16(20)19-17(21)23-15/h2-9H,1H3,(H,19,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.87E+4	n/a	n/a	n/a	n/a	7.9	n/a
University of Konstanz					Assay Description Pol β reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.9, 20mM KCl, 5% (v/v) glycerol, 1mM DTT, 2mM MnCl2, 250nM puri...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase beta (Homo sapiens (Human))	BDBM104068 ((Z)-5-(4-(Cyclohexylthio)-3-nitrobenzylidene)-2-th...) Show SMILES [O-][N+](=O)c1cc(C=C2SC(S)=NC2=O)ccc1SC1CCCCC1 |w:6.5,c:10| Show InChI InChI=1S/C16H16N2O3S3/c19-15-14(24-16(22)17-15)9-10-6-7-13(12(8-10)18(20)21)23-11-4-2-1-3-5-11/h6-9,11H,1-5H2,(H,17,19,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<5.00E+4	n/a	n/a	n/a	n/a	7.9	n/a
University of Konstanz					Assay Description Pol β reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.9, 20mM KCl, 5% (v/v) glycerol, 1mM DTT, 2mM MnCl2, 250nM puri...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase beta (Homo sapiens (Human))	BDBM104069 ((Z)-5-(3-Nitro-4-(p-tolylthio)benzylidene)thiazoli...) Show SMILES Cc1ccc(Sc2ccc(C=C3SC(O)=NC3=O)cc2[N+]([O-])=O)cc1 |w:10.9,c:14| Show InChI InChI=1S/C17H12N2O4S2/c1-10-2-5-12(6-3-10)24-14-7-4-11(8-13(14)19(22)23)9-15-16(20)18-17(21)25-15/h2-9H,1H3,(H,18,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	7.9	n/a
University of Konstanz					Assay Description Pol β reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.9, 20mM KCl, 5% (v/v) glycerol, 1mM DTT, 2mM MnCl2, 250nM puri...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase beta (Homo sapiens (Human))	BDBM104074 ((Z)-5-(1-(3-Nitro-4-(p-tolylthio)phenyl)ethylidene...) Show SMILES Cc1ccc(Sc2ccc(cc2[N+]([O-])=O)C(=C)c2sc(S)nc2O)cc1 Show InChI InChI=1S/C18H14N2O3S3/c1-10-3-6-13(7-4-10)25-15-8-5-12(9-14(15)20(22)23)11(2)16-17(21)19-18(24)26-16/h3-9,21H,2H2,1H3,(H,19,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<5.00E+4	n/a	n/a	n/a	n/a	7.9	n/a
University of Konstanz					Assay Description Pol β reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.9, 20mM KCl, 5% (v/v) glycerol, 1mM DTT, 2mM MnCl2, 250nM puri...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase beta (Homo sapiens (Human))	BDBM104098 ((Z)-5-((4-Bromo-5-(p-tolylthio)thiophen-2-yl)methy...) Show SMILES Cc1ccc(Sc2sc(C=C3SC(S)=NC3=O)cc2Br)cc1 |w:9.8,c:13| Show InChI InChI=1S/C15H10BrNOS4/c1-8-2-4-9(5-3-8)20-14-11(16)6-10(21-14)7-12-13(18)17-15(19)22-12/h2-7H,1H3,(H,17,18,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	<5.00E+4	n/a	n/a	n/a	n/a	7.9	n/a
University of Konstanz					Assay Description Pol β reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.9, 20mM KCl, 5% (v/v) glycerol, 1mM DTT, 2mM MnCl2, 250nM puri...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase beta (Homo sapiens (Human))	BDBM104097 ((Z)-5-(2,4-Bis(p-tolylthio)benzylidene)-2-thioxoth...) Show SMILES Cc1ccc(Sc2ccc(C=C3SC(S)=NC3=O)c(Sc3ccc(C)cc3)c2)cc1 |w:10.9,c:14| Show InChI InChI=1S/C24H19NOS4/c1-15-3-8-18(9-4-15)28-20-12-7-17(13-22-23(26)25-24(27)30-22)21(14-20)29-19-10-5-16(2)6-11-19/h3-14H,1-2H3,(H,25,26,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<5.00E+4	n/a	n/a	n/a	n/a	7.9	n/a
University of Konstanz					Assay Description Pol β reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.9, 20mM KCl, 5% (v/v) glycerol, 1mM DTT, 2mM MnCl2, 250nM puri...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase beta (Homo sapiens (Human))	BDBM104096 ((Z)-2-Thioxo-5-(4-(o-tolylthio)-3- (trifluoromethy...) Show SMILES Cc1ccccc1Sc1ccc(C=C2SC(S)=NC2=O)cc1C(F)(F)F |w:12.12,c:17| Show InChI InChI=1S/C18H12F3NOS3/c1-10-4-2-3-5-13(10)25-14-7-6-11(8-12(14)18(19,20)21)9-15-16(23)22-17(24)26-15/h2-9H,1H3,(H,22,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<5.00E+4	n/a	n/a	n/a	n/a	7.9	n/a
University of Konstanz					Assay Description Pol β reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.9, 20mM KCl, 5% (v/v) glycerol, 1mM DTT, 2mM MnCl2, 250nM puri...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase beta (Homo sapiens (Human))	BDBM104095 ((Z)-5-(3-Fluoro-4-(o-tolylthio)benzylidene)-2-thio...) Show SMILES Cc1ccccc1Sc1ccc(C=C2SC(S)=NC2=O)cc1F |w:12.12,c:17| Show InChI InChI=1S/C17H12FNOS3/c1-10-4-2-3-5-13(10)22-14-7-6-11(8-12(14)18)9-15-16(20)19-17(21)23-15/h2-9H,1H3,(H,19,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.00E+4	n/a	n/a	n/a	n/a	7.9	n/a
University of Konstanz					Assay Description Pol β reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.9, 20mM KCl, 5% (v/v) glycerol, 1mM DTT, 2mM MnCl2, 250nM puri...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase beta (Homo sapiens (Human))	BDBM104094 (23 (Z)-2-Thioxo-5-(4-(o-tolylthio)benzylidene)thia...) Show SMILES Cc1ccccc1Sc1ccc(C=C2SC(S)=NC2=O)cc1 |w:12.12,c:17| Show InChI InChI=1S/C17H13NOS3/c1-11-4-2-3-5-14(11)21-13-8-6-12(7-9-13)10-15-16(19)18-17(20)22-15/h2-10H,1H3,(H,18,19,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.00E+4	n/a	n/a	n/a	n/a	7.9	n/a
University of Konstanz					Assay Description Pol β reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.9, 20mM KCl, 5% (v/v) glycerol, 1mM DTT, 2mM MnCl2, 250nM puri...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase beta (Homo sapiens (Human))	BDBM104093 ((Z)-5-(3-Bromo-4-((3-fluoro-4-methylphenyl)thio)be...) Show SMILES Cc1ccc(Sc2ccc(C=C3SC(S)=NC3=O)cc2Br)cc1F |w:10.9,c:14| Show InChI InChI=1S/C17H11BrFNOS3/c1-9-2-4-11(8-13(9)19)23-14-5-3-10(6-12(14)18)7-15-16(21)20-17(22)24-15/h2-8H,1H3,(H,20,21,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	7.9	n/a
University of Konstanz					Assay Description Pol β reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.9, 20mM KCl, 5% (v/v) glycerol, 1mM DTT, 2mM MnCl2, 250nM puri...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase beta (Homo sapiens (Human))	BDBM104092 ((Z)-5-(4-(Cyclopentylthio)-3-nitrobenzylidene)-2-t...) Show SMILES [O-][N+](=O)c1cc(C=C2SC(S)=NC2=O)ccc1SC1CCCC1 |w:6.5,c:10| Show InChI InChI=1S/C15H14N2O3S3/c18-14-13(23-15(21)16-14)8-9-5-6-12(11(7-9)17(19)20)22-10-3-1-2-4-10/h5-8,10H,1-4H2,(H,16,18,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	7.9	n/a
University of Konstanz					Assay Description Pol β reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.9, 20mM KCl, 5% (v/v) glycerol, 1mM DTT, 2mM MnCl2, 250nM puri...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase beta (Homo sapiens (Human))	BDBM104091 ((Z)-5-(4-(Naphthalen-2-ylthio)-3-nitrobenzylidene)...) Show SMILES [O-][N+](=O)c1cc(C=C2SC(S)=NC2=O)ccc1Sc1ccc2ccccc2c1 |w:6.5,c:10| Show InChI InChI=1S/C20H12N2O3S3/c23-19-18(28-20(26)21-19)10-12-5-8-17(16(9-12)22(24)25)27-15-7-6-13-3-1-2-4-14(13)11-15/h1-11H,(H,21,23,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	7.9	n/a
University of Konstanz					Assay Description Pol β reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.9, 20mM KCl, 5% (v/v) glycerol, 1mM DTT, 2mM MnCl2, 250nM puri...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase beta (Homo sapiens (Human))	BDBM104090 ((Z)-5-(4-((3,5-Dimethylphenyl)thio)-3-nitrobenzyli...) Show SMILES Cc1cc(C)cc(Sc2ccc(C=C3SC(S)=NC3=O)cc2[N+]([O-])=O)c1 |w:12.11,c:16| Show InChI InChI=1S/C18H14N2O3S3/c1-10-5-11(2)7-13(6-10)25-15-4-3-12(8-14(15)20(22)23)9-16-17(21)19-18(24)26-16/h3-9H,1-2H3,(H,19,21,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<5.00E+4	n/a	n/a	n/a	n/a	7.9	n/a
University of Konstanz					Assay Description Pol β reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.9, 20mM KCl, 5% (v/v) glycerol, 1mM DTT, 2mM MnCl2, 250nM puri...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase beta (Homo sapiens (Human))	BDBM104087 ((Z)-5-(3-Nitro-4-((2,3,5,6-tetrafluoro-4-(trifluor...) Show SMILES [O-][N+](=O)c1cc(C=C2SC(S)=NC2=O)ccc1Sc1c(F)c(F)c(c(F)c1F)C(F)(F)F |w:6.5,c:10| Show InChI InChI=1S/C17H5F7N2O3S3/c18-10-9(17(22,23)24)11(19)13(21)14(12(10)20)31-7-2-1-5(3-6(7)26(28)29)4-8-15(27)25-16(30)32-8/h1-4H,(H,25,27,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	7.9	n/a
University of Konstanz					Assay Description Pol β reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.9, 20mM KCl, 5% (v/v) glycerol, 1mM DTT, 2mM MnCl2, 250nM puri...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase beta (Homo sapiens (Human))	BDBM104086 ((Z)-5-(4-((3-Fluoro-4-methylphenyl)thio)-3-nitrobe...) Show SMILES Cc1ccc(Sc2ccc(C=C3SC(S)=NC3=O)cc2[N+]([O-])=O)cc1F |w:10.9,c:14| Show InChI InChI=1S/C17H11FN2O3S3/c1-9-2-4-11(8-12(9)18)25-14-5-3-10(6-13(14)20(22)23)7-15-16(21)19-17(24)26-15/h2-8H,1H3,(H,19,21,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	7.9	n/a
University of Konstanz					Assay Description Pol β reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.9, 20mM KCl, 5% (v/v) glycerol, 1mM DTT, 2mM MnCl2, 250nM puri...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase beta (Homo sapiens (Human))	BDBM104085 ((Z)-5-(3-Nitro-4-((4-(trifluoromethoxy)phenyl)thio...) Show SMILES [O-][N+](=O)c1cc(C=C2SC(S)=NC2=O)ccc1Sc1ccc(OC(F)(F)F)cc1 |w:6.5,c:10| Show InChI InChI=1S/C17H9F3N2O4S3/c18-17(19,20)26-10-2-4-11(5-3-10)28-13-6-1-9(7-12(13)22(24)25)8-14-15(23)21-16(27)29-14/h1-8H,(H,21,23,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	7.9	n/a
University of Konstanz					Assay Description Pol β reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.9, 20mM KCl, 5% (v/v) glycerol, 1mM DTT, 2mM MnCl2, 250nM puri...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase beta (Homo sapiens (Human))	BDBM104084 ((Z)-5-(3-Nitro-4-((4-(trifluoromethyl)phenyl)thio)...) Show SMILES [O-][N+](=O)c1cc(C=C2SC(S)=NC2=O)ccc1Sc1ccc(cc1)C(F)(F)F |w:6.5,c:10| Show InChI InChI=1S/C17H9F3N2O3S3/c18-17(19,20)10-2-4-11(5-3-10)27-13-6-1-9(7-12(13)22(24)25)8-14-15(23)21-16(26)28-14/h1-8H,(H,21,23,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	7.9	n/a
University of Konstanz					Assay Description Pol β reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.9, 20mM KCl, 5% (v/v) glycerol, 1mM DTT, 2mM MnCl2, 250nM puri...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase beta (Homo sapiens (Human))	BDBM104083 ((Z)-5-(4-((4-Ethylphenyl)thio)-3-nitrobenzylidene)...) Show SMILES CCc1ccc(Sc2ccc(C=C3SC(S)=NC3=O)cc2[N+]([O-])=O)cc1 |w:11.10,c:15| Show InChI InChI=1S/C18H14N2O3S3/c1-2-11-3-6-13(7-4-11)25-15-8-5-12(9-14(15)20(22)23)10-16-17(21)19-18(24)26-16/h3-10H,2H2,1H3,(H,19,21,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<5.00E+4	n/a	n/a	n/a	n/a	7.9	n/a
University of Konstanz					Assay Description Pol β reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.9, 20mM KCl, 5% (v/v) glycerol, 1mM DTT, 2mM MnCl2, 250nM puri...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase beta (Homo sapiens (Human))	BDBM104080 ((Z)-5-(3-Bromo-4-(p-tolylthio)benzylidene)-2-thiox...) Show SMILES Cc1ccc(Sc2ccc(C=C3SC(S)=NC3=O)cc2Br)cc1 |w:10.9,c:14| Show InChI InChI=1S/C17H12BrNOS3/c1-10-2-5-12(6-3-10)22-14-7-4-11(8-13(14)18)9-15-16(20)19-17(21)23-15/h2-9H,1H3,(H,19,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	7.9	n/a
University of Konstanz					Assay Description Pol β reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.9, 20mM KCl, 5% (v/v) glycerol, 1mM DTT, 2mM MnCl2, 250nM puri...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair
DNA polymerase beta (Homo sapiens (Human))	BDBM104077 ((Z)-2-Thioxo-5-(4-(p-tolylthio)benzylidene)thiazol...) Show SMILES Cc1ccc(Sc2ccc(C=C3SC(S)=NC3=O)cc2)cc1 |w:10.9,c:14| Show InChI InChI=1S/C17H13NOS3/c1-11-2-6-13(7-3-11)21-14-8-4-12(5-9-14)10-15-16(19)18-17(20)22-15/h2-10H,1H3,(H,18,19,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<5.00E+4	n/a	n/a	n/a	n/a	7.9	n/a
University of Konstanz					Assay Description Pol β reactions were made in a final volume of 20uL containing 50mM Tris-HCl pH 7.9, 20mM KCl, 5% (v/v) glycerol, 1mM DTT, 2mM MnCl2, 250nM puri...				ACS Chem Biol 9: 282-90 (2014) Article DOI: 10.1021/cb4007562 BindingDB Entry DOI: 10.7270/Q20K276T
					More data for this Ligand-Target Pair

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