Compile Data Set for Download or QSAR

Found 127 hits of ic50 for UniProtKB: P07650   

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
Thymidine phosphorylase (Escherichia coli)	BDBM20079 (5-chloro-6-[(2-iminopyrrolidin-1-yl)methyl]-1,2,3,...) Show SMILES Clc1c(CN2CCCC2=N)[nH]c(=O)[nH]c1=O Show InChI InChI=1S/C9H11ClN4O2/c10-7-5(12-9(16)13-8(7)15)4-14-3-1-2-6(14)11/h11H,1-4H2,(H2,12,13,15,16)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibitory concentration against thymidine phosphorylase of Escherichia coli				J Med Chem 48: 392-402 (2005) Article DOI: 10.1021/jm049494r BindingDB Entry DOI: 10.7270/Q2445N8K
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM20079 (5-chloro-6-[(2-iminopyrrolidin-1-yl)methyl]-1,2,3,...) Show SMILES Clc1c(CN2CCCC2=N)[nH]c(=O)[nH]c1=O Show InChI InChI=1S/C9H11ClN4O2/c10-7-5(12-9(16)13-8(7)15)4-14-3-1-2-6(14)11/h11H,1-4H2,(H2,12,13,15,16)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of Thymidine phosphorylase from Escherichia coli				Bioorg Med Chem Lett 14: 5247-50 (2004) Article DOI: 10.1016/j.bmcl.2004.08.036 BindingDB Entry DOI: 10.7270/Q2PR7VGP
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM20079 (5-chloro-6-[(2-iminopyrrolidin-1-yl)methyl]-1,2,3,...) Show SMILES Clc1c(CN2CCCC2=N)[nH]c(=O)[nH]c1=O Show InChI InChI=1S/C9H11ClN4O2/c10-7-5(12-9(16)13-8(7)15)4-14-3-1-2-6(14)11/h11H,1-4H2,(H2,12,13,15,16)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	35	n/a	n/a	n/a	n/a	n/a	n/a
University of Karachi Curated by ChEMBL					Assay Description Inhibition of Escherichia coli thymidine phosphorylase				Bioorg Med Chem 17: 2983-8 (2009) Article DOI: 10.1016/j.bmc.2009.03.020 BindingDB Entry DOI: 10.7270/Q2GX4FC3
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM20079 (5-chloro-6-[(2-iminopyrrolidin-1-yl)methyl]-1,2,3,...) Show SMILES Clc1c(CN2CCCC2=N)[nH]c(=O)[nH]c1=O Show InChI InChI=1S/C9H11ClN4O2/c10-7-5(12-9(16)13-8(7)15)4-14-3-1-2-6(14)11/h11H,1-4H2,(H2,12,13,15,16)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	36	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of Escherichia coli Thymidine phosphorylase by spectrophotometry				Eur J Med Chem 46: 1165-71 (2011) Article DOI: 10.1016/j.ejmech.2011.01.035 BindingDB Entry DOI: 10.7270/Q2BP05MR
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM50122768 (2-Amino-1-(2,6-dioxo-1,2,3,6-tetrahydro-pyrimidin-...) Show SMILES Nc1[nH+]ccn1Cc1cc(=O)[nH]c(=O)[nH]1 Show InChI InChI=1S/C8H9N5O2/c9-7-10-1-2-13(7)4-5-3-6(14)12-8(15)11-5/h1-3H,4H2,(H2,9,10)(H2,11,12,14,15)/p+1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	560	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibitory concentration against thymidine phosphorylase of Escherichia coli				J Med Chem 48: 392-402 (2005) Article DOI: 10.1021/jm049494r BindingDB Entry DOI: 10.7270/Q2445N8K
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM50122770 (6-Amino-5-bromo-1H-pyrimidine-2,4-dione | 6-Amino-...) Show SMILES Nc1[nH]c(=O)[nH]c(=O)c1Br Show InChI InChI=1S/C4H4BrN3O2/c5-1-2(6)7-4(10)8-3(1)9/h(H4,6,7,8,9,10)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	1.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibitory concentration against thymidine phosphorylase of Escherichia coli				J Med Chem 48: 392-402 (2005) Article DOI: 10.1021/jm049494r BindingDB Entry DOI: 10.7270/Q2445N8K
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM50122770 (6-Amino-5-bromo-1H-pyrimidine-2,4-dione | 6-Amino-...) Show SMILES Nc1[nH]c(=O)[nH]c(=O)c1Br Show InChI InChI=1S/C4H4BrN3O2/c5-1-2(6)7-4(10)8-3(1)9/h(H4,6,7,8,9,10)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	1.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of Thymidine phosphorylase from Escherichia coli				Bioorg Med Chem Lett 14: 5247-50 (2004) Article DOI: 10.1016/j.bmcl.2004.08.036 BindingDB Entry DOI: 10.7270/Q2PR7VGP
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM20033 (6-(azetidin-1-yl)-5-bromo-1,3-diazinane-2,4-dione ...) Show SMILES Brc1c([nH]c(=O)[nH]c1=O)N1CCC1 Show InChI InChI=1S/C7H8BrN3O2/c8-4-5(11-2-1-3-11)9-7(13)10-6(4)12/h1-3H2,(H2,9,10,12,13)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	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
Academy of Sciences of the Czech Republic					Assay Description The enzyme reaction was started by the addition of enzyme to the reaction mixture containing substrate and test compounds. The reaction was stopped b...				Bioorg Med Chem Lett 16: 1335-7 (2006) Article DOI: 10.1016/j.bmcl.2005.11.050 BindingDB Entry DOI: 10.7270/Q2QR4VCH
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM20051 (5-bromo-6-[4-(5-bromo-2,6-dioxo-1,2,3,6-tetrahydro...) Show SMILES Brc1c([nH]c(=O)[nH]c1=O)N1CCN(CC1)c1[nH]c(=O)[nH]c(=O)c1Br Show InChI InChI=1S/C12H12Br2N6O4/c13-5-7(15-11(23)17-9(5)21)19-1-2-20(4-3-19)8-6(14)10(22)18-12(24)16-8/h1-4H2,(H2,15,17,21,23)(H2,16,18,22,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Academy of Sciences of the Czech Republic					Assay Description The enzyme reaction was started by the addition of enzyme to the reaction mixture containing substrate and test compounds. The reaction was stopped b...				Bioorg Med Chem Lett 16: 1335-7 (2006) Article DOI: 10.1016/j.bmcl.2005.11.050 BindingDB Entry DOI: 10.7270/Q2QR4VCH
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM50122765 (6-(2-Nitro-imidazol-1-ylmethyl)-1H-pyrimidine-2,4-...) Show SMILES [O-][N+](=O)c1nccn1Cc1cc(=[OH+])[n-]c(=[OH+])[n-]1 Show InChI InChI=1S/C8H7N5O4/c14-6-3-5(10-7(15)11-6)4-12-2-1-9-8(12)13(16)17/h1-3H,4H2,(H2,10,11,14,15)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibitory concentration against thymidine phosphorylase of Escherichia coli				J Med Chem 48: 392-402 (2005) Article DOI: 10.1021/jm049494r BindingDB Entry DOI: 10.7270/Q2445N8K
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM20052 (5-bromo-6-({2-[(5-bromo-2,6-dioxo-1,2,3,6-tetrahyd...) Show SMILES Brc1c(NCCNc2[nH]c(=O)[nH]c(=O)c2Br)[nH]c(=O)[nH]c1=O Show InChI InChI=1S/C10H10Br2N6O4/c11-3-5(15-9(21)17-7(3)19)13-1-2-14-6-4(12)8(20)18-10(22)16-6/h1-2H2,(H3,13,15,17,19,21)(H3,14,16,18,20,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Academy of Sciences of the Czech Republic					Assay Description The enzyme reaction was started by the addition of enzyme to the reaction mixture containing substrate and test compounds. The reaction was stopped b...				Bioorg Med Chem Lett 16: 1335-7 (2006) Article DOI: 10.1016/j.bmcl.2005.11.050 BindingDB Entry DOI: 10.7270/Q2QR4VCH
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM193765 ((E)-5-((2-(quinoxalin-2-yl)hydrazono)methyl)benzen...) Show SMILES Oc1cc(O)c(\C=N\Nc2cnc3ccccc3n2)cc1O Show InChI InChI=1S/C15H12N4O3/c20-12-6-14(22)13(21)5-9(12)7-17-19-15-8-16-10-3-1-2-4-11(10)18-15/h1-8,20-22H,(H,18,19)/b17-7+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
AIMST University Curated by ChEMBL					Assay Description Inhibition of Escherichia coli K12 thymidine phosphorylase expressed in Escherichia coli preincubated for 10 mins followed by substrate addition meas...				Eur J Med Chem 124: 992-1003 (2016) Article DOI: 10.1016/j.ejmech.2016.10.032 BindingDB Entry DOI: 10.7270/Q2RR218S
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM50274861 (CHEMBL4129729) Show SMILES Oc1ccc(-c2nnc(o2)-c2ccc(cc2)C(c2c[nH]c3ccc(Cl)cc23)c2c[nH]c3ccc(Cl)cc23)c(O)c1 Show InChI InChI=1S/C31H20Cl2N4O3/c32-18-5-9-26-22(11-18)24(14-34-26)29(25-15-35-27-10-6-19(33)12-23(25)27)16-1-3-17(4-2-16)30-36-37-31(40-30)21-8-7-20(38)13-28(21)39/h1-15,29,34-35,38-39H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Imam Abdulrahman Bin Faisal University Curated by ChEMBL					Assay Description Inhibition of Escherichia coli thymidine phosphorylase pretreated for 10 mins followed by substrate addition measured at 10 mins interval for 30 mins...				Bioorg Med Chem 26: 3654-3663 (2018) Article DOI: 10.1016/j.bmc.2018.05.046 BindingDB Entry DOI: 10.7270/Q22V2JKV
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM20036 (5-bromo-6-(cyclopropylamino)-1,3-diazinane-2,4-dio...) Show SMILES Brc1c(NC2CC2)[nH]c(=O)[nH]c1=O Show InChI InChI=1S/C7H8BrN3O2/c8-4-5(9-3-1-2-3)10-7(13)11-6(4)12/h3H,1-2H2,(H3,9,10,11,12,13)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Academy of Sciences of the Czech Republic					Assay Description The enzyme reaction was started by the addition of enzyme to the reaction mixture containing substrate and test compounds. The reaction was stopped b...				Bioorg Med Chem Lett 16: 1335-7 (2006) Article DOI: 10.1016/j.bmcl.2005.11.050 BindingDB Entry DOI: 10.7270/Q2QR4VCH
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM20030 (6-amino-5-chloro-1,3-diazinane-2,4-dione | 6-amino...) Show SMILES Nc1[nH]c(=O)[nH]c(=O)c1Cl Show InChI InChI=1S/C4H4ClN3O2/c5-1-2(6)7-4(10)8-3(1)9/h(H4,6,7,8,9,10)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Academy of Sciences of the Czech Republic					Assay Description The enzyme reaction was started by the addition of enzyme to the reaction mixture containing substrate and test compounds. The reaction was stopped b...				Bioorg Med Chem Lett 16: 1335-7 (2006) Article DOI: 10.1016/j.bmcl.2005.11.050 BindingDB Entry DOI: 10.7270/Q2QR4VCH
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM20047 (5-chloro-6-[2-(hydroxymethyl)piperidin-1-yl]-1,3-d...) Show SMILES OCC1CCCCN1c1[nH]c(=O)[nH]c(=O)c1Cl Show InChI InChI=1S/C10H14ClN3O3/c11-7-8(12-10(17)13-9(7)16)14-4-2-1-3-6(14)5-15/h6,15H,1-5H2,(H2,12,13,16,17)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Academy of Sciences of the Czech Republic					Assay Description The enzyme reaction was started by the addition of enzyme to the reaction mixture containing substrate and test compounds. The reaction was stopped b...				Bioorg Med Chem Lett 16: 1335-7 (2006) Article DOI: 10.1016/j.bmcl.2005.11.050 BindingDB Entry DOI: 10.7270/Q2QR4VCH
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM20034 (5-bromo-6-hydrazinyl-1,3-diazinane-2,4-dione | ura...) Show SMILES NNc1[nH]c(=O)[nH]c(=O)c1Br Show InChI InChI=1S/C4H5BrN4O2/c5-1-2(9-6)7-4(11)8-3(1)10/h6H2,(H3,7,8,9,10,11)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Academy of Sciences of the Czech Republic					Assay Description The enzyme reaction was started by the addition of enzyme to the reaction mixture containing substrate and test compounds. The reaction was stopped b...				Bioorg Med Chem Lett 16: 1335-7 (2006) Article DOI: 10.1016/j.bmcl.2005.11.050 BindingDB Entry DOI: 10.7270/Q2QR4VCH
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM20042 (5-chloro-6-(pyrrolidin-1-yl)-1,3-diazinane-2,4-dio...) Show SMILES Clc1c([nH]c(=O)[nH]c1=O)N1CCCC1 Show InChI InChI=1S/C8H10ClN3O2/c9-5-6(12-3-1-2-4-12)10-8(14)11-7(5)13/h1-4H2,(H2,10,11,13,14)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Academy of Sciences of the Czech Republic					Assay Description The enzyme reaction was started by the addition of enzyme to the reaction mixture containing substrate and test compounds. The reaction was stopped b...				Bioorg Med Chem Lett 16: 1335-7 (2006) Article DOI: 10.1016/j.bmcl.2005.11.050 BindingDB Entry DOI: 10.7270/Q2QR4VCH
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM20032 (5-bromo-6-(pyrrolidin-1-yl)-1,3-diazinane-2,4-dion...) Show SMILES Brc1c([nH]c(=O)[nH]c1=O)N1CCCC1 Show InChI InChI=1S/C8H10BrN3O2/c9-5-6(12-3-1-2-4-12)10-8(14)11-7(5)13/h1-4H2,(H2,10,11,13,14)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Academy of Sciences of the Czech Republic					Assay Description The enzyme reaction was started by the addition of enzyme to the reaction mixture containing substrate and test compounds. The reaction was stopped b...				Bioorg Med Chem Lett 16: 1335-7 (2006) Article DOI: 10.1016/j.bmcl.2005.11.050 BindingDB Entry DOI: 10.7270/Q2QR4VCH
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM20048 (5-chloro-6-[3-(hydroxymethyl)piperidin-1-yl]-1,3-d...) Show SMILES OCC1CCCN(C1)c1[nH]c(=O)[nH]c(=O)c1Cl Show InChI InChI=1S/C10H14ClN3O3/c11-7-8(12-10(17)13-9(7)16)14-3-1-2-6(4-14)5-15/h6,15H,1-5H2,(H2,12,13,16,17)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Academy of Sciences of the Czech Republic					Assay Description The enzyme reaction was started by the addition of enzyme to the reaction mixture containing substrate and test compounds. The reaction was stopped b...				Bioorg Med Chem Lett 16: 1335-7 (2006) Article DOI: 10.1016/j.bmcl.2005.11.050 BindingDB Entry DOI: 10.7270/Q2QR4VCH
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM20039 (5-bromo-6-[4-(hydroxymethyl)piperidin-1-yl]-1,3-di...) Show SMILES OCC1CCN(CC1)c1[nH]c(=O)[nH]c(=O)c1Br Show InChI InChI=1S/C10H14BrN3O3/c11-7-8(12-10(17)13-9(7)16)14-3-1-6(5-15)2-4-14/h6,15H,1-5H2,(H2,12,13,16,17)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Academy of Sciences of the Czech Republic					Assay Description The enzyme reaction was started by the addition of enzyme to the reaction mixture containing substrate and test compounds. The reaction was stopped b...				Bioorg Med Chem Lett 16: 1335-7 (2006) Article DOI: 10.1016/j.bmcl.2005.11.050 BindingDB Entry DOI: 10.7270/Q2QR4VCH
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM20050 (5-chloro-6-[4-(2-hydroxyethyl)piperidin-1-yl]-1,3-...) Show SMILES OCCC1CCN(CC1)c1[nH]c(=O)[nH]c(=O)c1Cl Show InChI InChI=1S/C11H16ClN3O3/c12-8-9(13-11(18)14-10(8)17)15-4-1-7(2-5-15)3-6-16/h7,16H,1-6H2,(H2,13,14,17,18)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Academy of Sciences of the Czech Republic					Assay Description The enzyme reaction was started by the addition of enzyme to the reaction mixture containing substrate and test compounds. The reaction was stopped b...				Bioorg Med Chem Lett 16: 1335-7 (2006) Article DOI: 10.1016/j.bmcl.2005.11.050 BindingDB Entry DOI: 10.7270/Q2QR4VCH
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM20040 (5-bromo-6-[4-(2-hydroxyethyl)piperidin-1-yl]-1,3-d...) Show SMILES OCCC1CCN(CC1)c1[nH]c(=O)[nH]c(=O)c1Br Show InChI InChI=1S/C11H16BrN3O3/c12-8-9(13-11(18)14-10(8)17)15-4-1-7(2-5-15)3-6-16/h7,16H,1-6H2,(H2,13,14,17,18)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Academy of Sciences of the Czech Republic					Assay Description The enzyme reaction was started by the addition of enzyme to the reaction mixture containing substrate and test compounds. The reaction was stopped b...				Bioorg Med Chem Lett 16: 1335-7 (2006) Article DOI: 10.1016/j.bmcl.2005.11.050 BindingDB Entry DOI: 10.7270/Q2QR4VCH
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM50274882 (CHEMBL4129587) Show SMILES Oc1ccc(O)c(c1)-c1nnc(o1)-c1ccc(cc1)C(c1c[nH]c2ccc(Cl)cc12)c1c[nH]c2ccc(Cl)cc12 Show InChI InChI=1S/C31H20Cl2N4O3/c32-18-5-8-26-21(11-18)24(14-34-26)29(25-15-35-27-9-6-19(33)12-22(25)27)16-1-3-17(4-2-16)30-36-37-31(40-30)23-13-20(38)7-10-28(23)39/h1-15,29,34-35,38-39H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Imam Abdulrahman Bin Faisal University Curated by ChEMBL					Assay Description Inhibition of Escherichia coli thymidine phosphorylase pretreated for 10 mins followed by substrate addition measured at 10 mins interval for 30 mins...				Bioorg Med Chem 26: 3654-3663 (2018) Article DOI: 10.1016/j.bmc.2018.05.046 BindingDB Entry DOI: 10.7270/Q22V2JKV
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM50134399 (1,7-Dihydro-pyrrolo[2,3-d]pyrimidine-2,4-dione | 7...) Show SMILES O=c1[nH]c2[nH]ccc2c(=O)[nH]1 Show InChI InChI=1S/C6H5N3O2/c10-5-3-1-2-7-4(3)8-6(11)9-5/h1-2H,(H3,7,8,9,10,11)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	6.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of Thymidine phosphorylase from Escherichia coli				Bioorg Med Chem Lett 14: 5247-50 (2004) Article DOI: 10.1016/j.bmcl.2004.08.036 BindingDB Entry DOI: 10.7270/Q2PR7VGP
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM20037 (5-bromo-6-[2-(hydroxymethyl)piperidin-1-yl]-1,3-di...) Show SMILES OCC1CCCCN1c1[nH]c(=O)[nH]c(=O)c1Br Show InChI InChI=1S/C10H14BrN3O3/c11-7-8(12-10(17)13-9(7)16)14-4-2-1-3-6(14)5-15/h6,15H,1-5H2,(H2,12,13,16,17)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Academy of Sciences of the Czech Republic					Assay Description The enzyme reaction was started by the addition of enzyme to the reaction mixture containing substrate and test compounds. The reaction was stopped b...				Bioorg Med Chem Lett 16: 1335-7 (2006) Article DOI: 10.1016/j.bmcl.2005.11.050 BindingDB Entry DOI: 10.7270/Q2QR4VCH
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM20038 (5-bromo-6-[3-(hydroxymethyl)piperidin-1-yl]-1,3-di...) Show SMILES OCC1CCCN(C1)c1[nH]c(=O)[nH]c(=O)c1Br Show InChI InChI=1S/C10H14BrN3O3/c11-7-8(12-10(17)13-9(7)16)14-3-1-2-6(4-14)5-15/h6,15H,1-5H2,(H2,12,13,16,17)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Academy of Sciences of the Czech Republic					Assay Description The enzyme reaction was started by the addition of enzyme to the reaction mixture containing substrate and test compounds. The reaction was stopped b...				Bioorg Med Chem Lett 16: 1335-7 (2006) Article DOI: 10.1016/j.bmcl.2005.11.050 BindingDB Entry DOI: 10.7270/Q2QR4VCH
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM50159217 (4-Amino-1-(5-bromo-2,6-dioxo-1,2,3,6-tetrahydro-py...) Show SMILES Nc1c[n+](Cc2[nH]c(=O)[nH]c(=O)c2Br)c[nH]1 Show InChI InChI=1S/C8H8BrN5O2/c9-6-4(12-8(16)13-7(6)15)1-14-2-5(10)11-3-14/h2-3H,1,10H2,(H2,12,13,15,16)/p+1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibitory concentration against thymidine phosphorylase of Escherichia coli				J Med Chem 48: 392-402 (2005) Article DOI: 10.1021/jm049494r BindingDB Entry DOI: 10.7270/Q2445N8K
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM50159222 (5-Bromo-6-(4-nitro-imidazol-1-ylmethyl)-1H-pyrimid...) Show SMILES [O-][N+](=O)c1cn(Cc2[n-]c(=[OH+])[nH]c(=O)c2Br)cn1 Show InChI InChI=1S/C8H6BrN5O4/c9-6-4(11-8(16)12-7(6)15)1-13-2-5(10-3-13)14(17)18/h2-3H,1H2,(H2,11,12,15,16)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank 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
University of Manchester Curated by ChEMBL					Assay Description Inhibitory concentration against thymidine phosphorylase of Escherichia coli				J Med Chem 48: 392-402 (2005) Article DOI: 10.1021/jm049494r BindingDB Entry DOI: 10.7270/Q2445N8K
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM50159219 (5-Chloro-6-(4-nitro-imidazol-1-ylmethyl)-1H-pyrimi...) Show SMILES [O-][N+](=O)c1cn(Cc2[n-]c(=[OH+])[nH]c(=O)c2Cl)cn1 Show InChI InChI=1S/C8H6ClN5O4/c9-6-4(11-8(16)12-7(6)15)1-13-2-5(10-3-13)14(17)18/h2-3H,1H2,(H2,11,12,15,16)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibitory concentration against thymidine phosphorylase of Escherichia coli				J Med Chem 48: 392-402 (2005) Article DOI: 10.1021/jm049494r BindingDB Entry DOI: 10.7270/Q2445N8K
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM20041 (5-chloro-6-(piperidin-1-yl)-1,3-diazinane-2,4-dion...) Show SMILES Clc1c([nH]c(=O)[nH]c1=O)N1CCCCC1 Show InChI InChI=1S/C9H12ClN3O2/c10-6-7(11-9(15)12-8(6)14)13-4-2-1-3-5-13/h1-5H2,(H2,11,12,14,15)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Academy of Sciences of the Czech Republic					Assay Description The enzyme reaction was started by the addition of enzyme to the reaction mixture containing substrate and test compounds. The reaction was stopped b...				Bioorg Med Chem Lett 16: 1335-7 (2006) Article DOI: 10.1016/j.bmcl.2005.11.050 BindingDB Entry DOI: 10.7270/Q2QR4VCH
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM50159220 (4-Amino-1-(5-chloro-2,6-dioxo-1,2,3,6-tetrahydro-p...) Show SMILES Nc1c[n+](Cc2[nH]c(=O)[nH]c(=O)c2Cl)c[nH]1 Show InChI InChI=1S/C8H8ClN5O2/c9-6-4(12-8(16)13-7(6)15)1-14-2-5(10)11-3-14/h2-3H,1,10H2,(H2,12,13,15,16)/p+1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibitory concentration against thymidine phosphorylase of Escherichia coli				J Med Chem 48: 392-402 (2005) Article DOI: 10.1021/jm049494r BindingDB Entry DOI: 10.7270/Q2445N8K
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM20049 (5-chloro-6-[4-(hydroxymethyl)piperidin-1-yl]-1,3-d...) Show SMILES OCC1CCN(CC1)c1[nH]c(=O)[nH]c(=O)c1Cl Show InChI InChI=1S/C10H14ClN3O3/c11-7-8(12-10(17)13-9(7)16)14-3-1-6(5-15)2-4-14/h6,15H,1-5H2,(H2,12,13,16,17)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	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
Academy of Sciences of the Czech Republic					Assay Description The enzyme reaction was started by the addition of enzyme to the reaction mixture containing substrate and test compounds. The reaction was stopped b...				Bioorg Med Chem Lett 16: 1335-7 (2006) Article DOI: 10.1016/j.bmcl.2005.11.050 BindingDB Entry DOI: 10.7270/Q2QR4VCH
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM222044 (5'-O-(4''-Bromobenzoyl)-thymidine-3...) Show SMILES Cc1cn([C@H]2C[C@H](OC(=O)c3ccc(Br)cc3)[C@@H](COC(=O)c3ccc(Br)cc3)O2)c(=O)[nH]c1=O |r| Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.50E+3	n/a	n/a	n/a	n/a	n/a	30
University of Karachi					Assay Description TP inhibition assay was performed spectrophotometrically in 96-well plate. The method of Bera et al. was followed with slight modifications [Bera et ...				Bioorg Chem 70: 44-56 (2017) Article DOI: 10.1016/j.bioorg.2016.11.007 BindingDB Entry DOI: 10.7270/Q2H70DPM
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM20053 (5-chloro-6-[4-(5-chloro-2,6-dioxo-1,2,3,6-tetrahyd...) Show SMILES Clc1c([nH]c(=O)[nH]c1=O)N1CCN(CC1)c1[nH]c(=O)[nH]c(=O)c1Cl Show InChI InChI=1S/C12H12Cl2N6O4/c13-5-7(15-11(23)17-9(5)21)19-1-2-20(4-3-19)8-6(14)10(22)18-12(24)16-8/h1-4H2,(H2,15,17,21,23)(H2,16,18,22,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Academy of Sciences of the Czech Republic					Assay Description The enzyme reaction was started by the addition of enzyme to the reaction mixture containing substrate and test compounds. The reaction was stopped b...				Bioorg Med Chem Lett 16: 1335-7 (2006) Article DOI: 10.1016/j.bmcl.2005.11.050 BindingDB Entry DOI: 10.7270/Q2QR4VCH
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM20044 (5-chloro-6-hydrazinyl-1,3-diazinane-2,4-dione | ur...) Show SMILES NNc1[nH]c(=O)[nH]c(=O)c1Cl Show InChI InChI=1S/C4H5ClN4O2/c5-1-2(9-6)7-4(11)8-3(1)10/h6H2,(H3,7,8,9,10,11)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Academy of Sciences of the Czech Republic					Assay Description The enzyme reaction was started by the addition of enzyme to the reaction mixture containing substrate and test compounds. The reaction was stopped b...				Bioorg Med Chem Lett 16: 1335-7 (2006) Article DOI: 10.1016/j.bmcl.2005.11.050 BindingDB Entry DOI: 10.7270/Q2QR4VCH
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM20031 (5-bromo-6-(piperidin-1-yl)-1,3-diazinane-2,4-dione...) Show SMILES Brc1c([nH]c(=O)[nH]c1=O)N1CCCCC1 Show InChI InChI=1S/C9H12BrN3O2/c10-6-7(11-9(15)12-8(6)14)13-4-2-1-3-5-13/h1-5H2,(H2,11,12,14,15)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Academy of Sciences of the Czech Republic					Assay Description The enzyme reaction was started by the addition of enzyme to the reaction mixture containing substrate and test compounds. The reaction was stopped b...				Bioorg Med Chem Lett 16: 1335-7 (2006) Article DOI: 10.1016/j.bmcl.2005.11.050 BindingDB Entry DOI: 10.7270/Q2QR4VCH
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM50274865 (CHEMBL4125852) Show SMILES Fc1ccc(cc1)-c1nnc(o1)-c1ccc(cc1)C(c1c[nH]c2ccc(Cl)cc12)c1c[nH]c2ccc(Cl)cc12 Show InChI InChI=1S/C31H19Cl2FN4O/c32-20-7-11-27-23(13-20)25(15-35-27)29(26-16-36-28-12-8-21(33)14-24(26)28)17-1-3-18(4-2-17)30-37-38-31(39-30)19-5-9-22(34)10-6-19/h1-16,29,35-36H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Imam Abdulrahman Bin Faisal University Curated by ChEMBL					Assay Description Inhibition of Escherichia coli thymidine phosphorylase pretreated for 10 mins followed by substrate addition measured at 10 mins interval for 30 mins...				Bioorg Med Chem 26: 3654-3663 (2018) Article DOI: 10.1016/j.bmc.2018.05.046 BindingDB Entry DOI: 10.7270/Q22V2JKV
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM50274863 (CHEMBL4126296) Show SMILES Oc1cccc(-c2nnc(o2)-c2ccc(cc2)C(c2c[nH]c3ccc(Cl)cc23)c2c[nH]c3ccc(Cl)cc23)c1O Show InChI InChI=1S/C31H20Cl2N4O3/c32-18-8-10-25-21(12-18)23(14-34-25)28(24-15-35-26-11-9-19(33)13-22(24)26)16-4-6-17(7-5-16)30-36-37-31(40-30)20-2-1-3-27(38)29(20)39/h1-15,28,34-35,38-39H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Imam Abdulrahman Bin Faisal University Curated by ChEMBL					Assay Description Inhibition of Escherichia coli thymidine phosphorylase pretreated for 10 mins followed by substrate addition measured at 10 mins interval for 30 mins...				Bioorg Med Chem 26: 3654-3663 (2018) Article DOI: 10.1016/j.bmc.2018.05.046 BindingDB Entry DOI: 10.7270/Q22V2JKV
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM20046 (5-chloro-6-(cyclopropylamino)-1,3-diazinane-2,4-di...) Show SMILES Clc1c(NC2CC2)[nH]c(=O)[nH]c1=O Show InChI InChI=1S/C7H8ClN3O2/c8-4-5(9-3-1-2-3)10-7(13)11-6(4)12/h3H,1-2H2,(H3,9,10,11,12,13)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.01E+4	n/a	n/a	n/a	n/a	n/a	n/a
Academy of Sciences of the Czech Republic					Assay Description The enzyme reaction was started by the addition of enzyme to the reaction mixture containing substrate and test compounds. The reaction was stopped b...				Bioorg Med Chem Lett 16: 1335-7 (2006) Article DOI: 10.1016/j.bmcl.2005.11.050 BindingDB Entry DOI: 10.7270/Q2QR4VCH
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM20045 (5-chloro-6-(morpholin-4-yl)-1,3-diazinane-2,4-dion...) Show SMILES Clc1c([nH]c(=O)[nH]c1=O)N1CCOCC1 Show InChI InChI=1S/C8H10ClN3O3/c9-5-6(10-8(14)11-7(5)13)12-1-3-15-4-2-12/h1-4H2,(H2,10,11,13,14)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.04E+4	n/a	n/a	n/a	n/a	n/a	n/a
Academy of Sciences of the Czech Republic					Assay Description The enzyme reaction was started by the addition of enzyme to the reaction mixture containing substrate and test compounds. The reaction was stopped b...				Bioorg Med Chem Lett 16: 1335-7 (2006) Article DOI: 10.1016/j.bmcl.2005.11.050 BindingDB Entry DOI: 10.7270/Q2QR4VCH
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM20035 (5-bromo-6-(morpholin-4-yl)-1,3-diazinane-2,4-dione...) Show SMILES Brc1c([nH]c(=O)[nH]c1=O)N1CCOCC1 Show InChI InChI=1S/C8H10BrN3O3/c9-5-6(10-8(14)11-7(5)13)12-1-3-15-4-2-12/h1-4H2,(H2,10,11,13,14)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.16E+4	n/a	n/a	n/a	n/a	n/a	n/a
Academy of Sciences of the Czech Republic					Assay Description The enzyme reaction was started by the addition of enzyme to the reaction mixture containing substrate and test compounds. The reaction was stopped b...				Bioorg Med Chem Lett 16: 1335-7 (2006) Article DOI: 10.1016/j.bmcl.2005.11.050 BindingDB Entry DOI: 10.7270/Q2QR4VCH
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM50274883 (CHEMBL4126143) Show SMILES Oc1ccc(cc1O)-c1nnc(o1)-c1ccc(cc1)C(c1c[nH]c2ccc(Cl)cc12)c1c[nH]c2ccc(Cl)cc12 Show InChI InChI=1S/C31H20Cl2N4O3/c32-19-6-8-25-21(12-19)23(14-34-25)29(24-15-35-26-9-7-20(33)13-22(24)26)16-1-3-17(4-2-16)30-36-37-31(40-30)18-5-10-27(38)28(39)11-18/h1-15,29,34-35,38-39H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.22E+4	n/a	n/a	n/a	n/a	n/a	n/a
Imam Abdulrahman Bin Faisal University Curated by ChEMBL					Assay Description Inhibition of Escherichia coli thymidine phosphorylase pretreated for 10 mins followed by substrate addition measured at 10 mins interval for 30 mins...				Bioorg Med Chem 26: 3654-3663 (2018) Article DOI: 10.1016/j.bmc.2018.05.046 BindingDB Entry DOI: 10.7270/Q22V2JKV
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM50159218 (6-(4-Nitro-imidazol-1-ylmethyl)-1H-pyrimidine-2,4-...) Show SMILES [O-][N+](=O)c1cn(Cc2cc(=[OH+])[n-]c(=[OH+])[n-]2)cn1 Show InChI InChI=1S/C8H7N5O4/c14-7-1-5(10-8(15)11-7)2-12-3-6(9-4-12)13(16)17/h1,3-4H,2H2,(H2,10,11,14,15)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.38E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibitory concentration against thymidine phosphorylase of Escherichia coli				J Med Chem 48: 392-402 (2005) Article DOI: 10.1021/jm049494r BindingDB Entry DOI: 10.7270/Q2445N8K
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM20043 (6-(azetidin-1-yl)-5-chloro-1,3-diazinane-2,4-dione...) Show SMILES Clc1c([nH]c(=O)[nH]c1=O)N1CCC1 Show InChI InChI=1S/C7H8ClN3O2/c8-4-5(11-2-1-3-11)9-7(13)10-6(4)12/h1-3H2,(H2,9,10,12,13)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
Academy of Sciences of the Czech Republic					Assay Description The enzyme reaction was started by the addition of enzyme to the reaction mixture containing substrate and test compounds. The reaction was stopped b...				Bioorg Med Chem Lett 16: 1335-7 (2006) Article DOI: 10.1016/j.bmcl.2005.11.050 BindingDB Entry DOI: 10.7270/Q2QR4VCH
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM50495303 (CHEMBL3103184) Show SMILES COc1ccc(cc1NCn1nc(oc1=S)-c1ccc(C)cc1)[N+]([O-])=O Show InChI InChI=1S/C17H16N4O4S/c1-11-3-5-12(6-4-11)16-19-20(17(26)25-16)10-18-14-9-13(21(22)23)7-8-15(14)24-2/h3-9,18H,10H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.44E+4	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Information Technology Curated by ChEMBL					Assay Description Inhibition of Escherichia coli thymidine phosphorylase using thymidine 5' mono phosphate as substrate after 10 mins by spectrophotometric analysis				Bioorg Med Chem 22: 1008-15 (2014) Article DOI: 10.1016/j.bmc.2013.12.043 BindingDB Entry DOI: 10.7270/Q25T3PFP
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM50274866 (CHEMBL4127084) Show SMILES Fc1ccccc1-c1nnc(o1)-c1ccc(cc1)C(c1c[nH]c2ccc(Cl)cc12)c1c[nH]c2ccc(Cl)cc12 Show InChI InChI=1S/C31H19Cl2FN4O/c32-19-9-11-27-22(13-19)24(15-35-27)29(25-16-36-28-12-10-20(33)14-23(25)28)17-5-7-18(8-6-17)30-37-38-31(39-30)21-3-1-2-4-26(21)34/h1-16,29,35-36H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.73E+4	n/a	n/a	n/a	n/a	n/a	n/a
Imam Abdulrahman Bin Faisal University Curated by ChEMBL					Assay Description Inhibition of Escherichia coli thymidine phosphorylase pretreated for 10 mins followed by substrate addition measured at 10 mins interval for 30 mins...				Bioorg Med Chem 26: 3654-3663 (2018) Article DOI: 10.1016/j.bmc.2018.05.046 BindingDB Entry DOI: 10.7270/Q22V2JKV
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Thymidine phosphorylase (Escherichia coli)	BDBM50495302 (CHEMBL3103314) Show SMILES COc1ccccc1NCn1nc(oc1=S)-c1ccccc1Br Show InChI InChI=1S/C16H14BrN3O2S/c1-21-14-9-5-4-8-13(14)18-10-20-16(23)22-15(19-20)11-6-2-3-7-12(11)17/h2-9,18H,10H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.76E+4	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Information Technology Curated by ChEMBL					Assay Description Inhibition of Escherichia coli thymidine phosphorylase using thymidine 5' mono phosphate as substrate after 10 mins by spectrophotometric analysis				Bioorg Med Chem 22: 1008-15 (2014) Article DOI: 10.1016/j.bmc.2013.12.043 BindingDB Entry DOI: 10.7270/Q25T3PFP
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM222040 (5'-O-(4''-Methylbenzoyl)-thymidine (4)) Show SMILES Cc1ccc(cc1)C(=O)OC[C@H]1O[C@H](C[C@@H]1O)n1cc(C)c(=O)[nH]c1=O |r| Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.85E+4	n/a	n/a	n/a	n/a	n/a	30
University of Karachi					Assay Description TP inhibition assay was performed spectrophotometrically in 96-well plate. The method of Bera et al. was followed with slight modifications [Bera et ...				Bioorg Chem 70: 44-56 (2017) Article DOI: 10.1016/j.bioorg.2016.11.007 BindingDB Entry DOI: 10.7270/Q2H70DPM
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Escherichia coli)	BDBM222041 (5'-O-(4''-Methoxybenzoyl)-thymidine (1...) Show SMILES COc1ccc(cc1)C(=O)OC[C@H]1O[C@H](C[C@@H]1O)n1cc(C)c(=O)[nH]c1=O |r| Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.88E+4	n/a	n/a	n/a	n/a	n/a	30
University of Karachi					Assay Description TP inhibition assay was performed spectrophotometrically in 96-well plate. The method of Bera et al. was followed with slight modifications [Bera et ...				Bioorg Chem 70: 44-56 (2017) Article DOI: 10.1016/j.bioorg.2016.11.007 BindingDB Entry DOI: 10.7270/Q2H70DPM
					More data for this Ligand-Target Pair

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