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Compile Data Set for Download or QSAR

Found 58 hits with Last Name = 'tender' and Initial = 'g'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM50179250
PNG
(CHEMBL3813826)
Show SMILES OC(=O)C1=NN(C(=O)\C1=C/c1ccc(cc1)N(CCC#N)CCC#N)c1ccc(cc1)S(O)(=O)=O
Show InChI InChI=1S/C23H19N5O6S/c24-11-1-13-27(14-2-12-25)17-5-3-16(4-6-17)15-20-21(23(30)31)26-28(22(20)29)18-7-9-19(10-8-18)35(32,33)34/h3-10,15H,1-2,13-14H2,(H,30,31)(H,32,33,34)/b20-15-
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n/an/a 3.50E+3n/an/an/an/an/an/a



Georgia State University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TDP2 using alpha32P-cordycepin-3'-labeled TY19 as substrate after 15 mins by PAGE method


Bioorg Med Chem Lett 26: 3232-3236 (2016)


Article DOI: 10.1016/j.bmcl.2016.05.065
BindingDB Entry DOI: 10.7270/Q22809HF
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM50179184
PNG
(CHEMBL264425)
Show SMILES OC(=O)C(CSSCC(NC(=O)c1ccccc1)C(O)=O)NC(=O)c1ccccc1
Show InChI InChI=1S/C20H20N2O6S2/c23-17(13-7-3-1-4-8-13)21-15(19(25)26)11-29-30-12-16(20(27)28)22-18(24)14-9-5-2-6-10-14/h1-10,15-16H,11-12H2,(H,21,23)(H,22,24)(H,25,26)(H,27,28)
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n/an/a 4.10E+3n/an/an/an/an/an/a



Georgia State University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TDP2 using alpha32P-cordycepin-3'-labeled TY19 as substrate after 15 mins by PAGE method


Bioorg Med Chem Lett 26: 3232-3236 (2016)


Article DOI: 10.1016/j.bmcl.2016.05.065
BindingDB Entry DOI: 10.7270/Q22809HF
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Danio rerio)
BDBM50179250
PNG
(CHEMBL3813826)
Show SMILES OC(=O)C1=NN(C(=O)\C1=C/c1ccc(cc1)N(CCC#N)CCC#N)c1ccc(cc1)S(O)(=O)=O
Show InChI InChI=1S/C23H19N5O6S/c24-11-1-13-27(14-2-12-25)17-5-3-16(4-6-17)15-20-21(23(30)31)26-28(22(20)29)18-7-9-19(10-8-18)35(32,33)34/h3-10,15H,1-2,13-14H2,(H,30,31)(H,32,33,34)/b20-15-
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n/an/a 5.20E+3n/an/an/an/an/an/a



Georgia State University

Curated by ChEMBL


Assay Description
Inhibition of zebra fish recombinant TDP2 using alpha32P-cordycepin-3'-labeled TY19 as substrate after 15 mins by PAGE method


Bioorg Med Chem Lett 26: 3232-3236 (2016)


Article DOI: 10.1016/j.bmcl.2016.05.065
BindingDB Entry DOI: 10.7270/Q22809HF
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM50179183
PNG
(CHEMBL576840 | NSC-3198)
Show SMILES OC(=O)C(CSSCC(NC(=O)Cc1ccccc1)C(O)=O)NC(=O)Cc1ccccc1
Show InChI InChI=1S/C22H24N2O6S2/c25-19(11-15-7-3-1-4-8-15)23-17(21(27)28)13-31-32-14-18(22(29)30)24-20(26)12-16-9-5-2-6-10-16/h1-10,17-18H,11-14H2,(H,23,25)(H,24,26)(H,27,28)(H,29,30)
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n/an/a 9.00E+3n/an/an/an/an/an/a



Georgia State University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TDP2 using alpha32P-cordycepin-3'-labeled TY19 as substrate after 15 mins by PAGE method


Bioorg Med Chem Lett 26: 3232-3236 (2016)


Article DOI: 10.1016/j.bmcl.2016.05.065
BindingDB Entry DOI: 10.7270/Q22809HF
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM50179251
PNG
(CHEMBL3814209)
Show SMILES COc1ccc(CC2C(=O)N(N=C2C(O)=O)c2ccc(cc2)[N+]([O-])=O)cc1Oc1ccc(F)cc1
Show InChI InChI=1S/C24H18FN3O7/c1-34-20-11-2-14(13-21(20)35-18-9-3-15(25)4-10-18)12-19-22(24(30)31)26-27(23(19)29)16-5-7-17(8-6-16)28(32)33/h2-11,13,19H,12H2,1H3,(H,30,31)
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n/an/a 1.20E+4n/an/an/an/an/an/a



Georgia State University

Curated by ChEMBL


Assay Description
Inhibition of human TDP2


Bioorg Med Chem Lett 26: 3232-3236 (2016)


Article DOI: 10.1016/j.bmcl.2016.05.065
BindingDB Entry DOI: 10.7270/Q22809HF
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1 (TDP1)


(Homo sapiens (Human))
BDBM50388544
PNG
(CHEMBL2057323)
Show SMILES O=C1c2ccccc2-c2c1c1ccccc1c(=O)n2CCCNCCCNCCCn1c2-c3ccccc3C(=O)c2c2ccccc2c1=O
Show InChI InChI=1S/C41H36N4O4/c46-38-30-16-5-3-14-28(30)36-34(38)26-12-1-7-18-32(26)40(48)44(36)24-10-22-42-20-9-21-43-23-11-25-45-37-29-15-4-6-17-31(29)39(47)35(37)27-13-2-8-19-33(27)41(45)49/h1-8,12-19,42-43H,9-11,20-25H2
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n/an/a 1.20E+4n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of recombinant TPD1 (unknown origin) activity using 3'-phosphotyrosine-containing 5'-[32P]-labeled single-stranded DNA oligonucleotide by ...


J Med Chem 58: 3997-4015 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00303
BindingDB Entry DOI: 10.7270/Q2DN46S6
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2 (mTDP2 WT)


(Mus musculus (Mouse))
BDBM50179250
PNG
(CHEMBL3813826)
Show SMILES OC(=O)C1=NN(C(=O)\C1=C/c1ccc(cc1)N(CCC#N)CCC#N)c1ccc(cc1)S(O)(=O)=O
Show InChI InChI=1S/C23H19N5O6S/c24-11-1-13-27(14-2-12-25)17-5-3-16(4-6-17)15-20-21(23(30)31)26-28(22(20)29)18-7-9-19(10-8-18)35(32,33)34/h3-10,15H,1-2,13-14H2,(H,30,31)(H,32,33,34)/b20-15-
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n/an/a 1.50E+4n/an/an/an/an/an/a



Georgia State University

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant TDP2 using alpha32P-cordycepin-3'-labeled TY19 as substrate after 15 mins by PAGE method


Bioorg Med Chem Lett 26: 3232-3236 (2016)


Article DOI: 10.1016/j.bmcl.2016.05.065
BindingDB Entry DOI: 10.7270/Q22809HF
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Danio rerio)
BDBM50179184
PNG
(CHEMBL264425)
Show SMILES OC(=O)C(CSSCC(NC(=O)c1ccccc1)C(O)=O)NC(=O)c1ccccc1
Show InChI InChI=1S/C20H20N2O6S2/c23-17(13-7-3-1-4-8-13)21-15(19(25)26)11-29-30-12-16(20(27)28)22-18(24)14-9-5-2-6-10-14/h1-10,15-16H,11-12H2,(H,21,23)(H,22,24)(H,25,26)(H,27,28)
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n/an/a 1.50E+4n/an/an/an/an/an/a



Georgia State University

Curated by ChEMBL


Assay Description
Inhibition of zebra fish recombinant TDP2 using alpha32P-cordycepin-3'-labeled TY19 as substrate after 15 mins by PAGE method


Bioorg Med Chem Lett 26: 3232-3236 (2016)


Article DOI: 10.1016/j.bmcl.2016.05.065
BindingDB Entry DOI: 10.7270/Q22809HF
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1


(Homo sapiens (Human))
BDBM50172715
PNG
(CHEMBL3808646)
Show SMILES Cl.Cl.NCCCn1c2-c3ccccc3C(=O)c2c2cnccc2c1=O
Show InChI InChI=1S/C18H15N3O2.2ClH/c19-7-3-9-21-16-11-4-1-2-5-12(11)17(22)15(16)14-10-20-8-6-13(14)18(21)23;;/h1-2,4-6,8,10H,3,7,9,19H2;2*1H
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n/an/a 1.90E+4n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of recombinant TDP1 (unknown origin) using single stranded 5'-[32P]-labeled DNA containing 3'-phosphotyrosine as substrate after 15 mins b...


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Danio rerio)
BDBM50179183
PNG
(CHEMBL576840 | NSC-3198)
Show SMILES OC(=O)C(CSSCC(NC(=O)Cc1ccccc1)C(O)=O)NC(=O)Cc1ccccc1
Show InChI InChI=1S/C22H24N2O6S2/c25-19(11-15-7-3-1-4-8-15)23-17(21(27)28)13-31-32-14-18(22(29)30)24-20(26)12-16-9-5-2-6-10-16/h1-10,17-18H,11-14H2,(H,23,25)(H,24,26)(H,27,28)(H,29,30)
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n/an/a 2.00E+4n/an/an/an/an/an/a



Georgia State University

Curated by ChEMBL


Assay Description
Inhibition of zebra fish recombinant TDP2 using alpha32P-cordycepin-3'-labeled TY19 as substrate after 15 mins by PAGE method


Bioorg Med Chem Lett 26: 3232-3236 (2016)


Article DOI: 10.1016/j.bmcl.2016.05.065
BindingDB Entry DOI: 10.7270/Q22809HF
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1


(Homo sapiens (Human))
BDBM50172712
PNG
(CHEMBL3810182)
Show SMILES Cl.Cl.NCCCn1c2-c3ccccc3C(=O)c2c2ccncc2c1=O
Show InChI InChI=1S/C18H15N3O2.2ClH/c19-7-3-9-21-16-12-4-1-2-5-13(12)17(22)15(16)11-6-8-20-10-14(11)18(21)23;;/h1-2,4-6,8,10H,3,7,9,19H2;2*1H
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n/an/a 3.00E+4n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of recombinant TDP1 (unknown origin) using single stranded 5'-[32P]-labeled DNA containing 3'-phosphotyrosine as substrate after 15 mins b...


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM50090918
PNG
(CHEMBL3581877)
Show SMILES CN(C)CCCn1c2-c3ccccc3C(=O)c2c2ccncc2c1=O
Show InChI InChI=1S/C20H19N3O2/c1-22(2)10-5-11-23-18-14-6-3-4-7-15(14)19(24)17(18)13-8-9-21-12-16(13)20(23)25/h3-4,6-9,12H,5,10-11H2,1-2H3
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n/an/a 3.70E+4n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TPD2 activity using 5'phosphotyrosine-containing 19-mer single-stranded oligonucleotide DNA substrate by PAGE assay


J Med Chem 58: 3997-4015 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00303
BindingDB Entry DOI: 10.7270/Q2DN46S6
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1 (TDP1)


(Homo sapiens (Human))
BDBM50090918
PNG
(CHEMBL3581877)
Show SMILES CN(C)CCCn1c2-c3ccccc3C(=O)c2c2ccncc2c1=O
Show InChI InChI=1S/C20H19N3O2/c1-22(2)10-5-11-23-18-14-6-3-4-7-15(14)19(24)17(18)13-8-9-21-12-16(13)20(23)25/h3-4,6-9,12H,5,10-11H2,1-2H3
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n/an/a 3.70E+4n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of recombinant TPD1 (unknown origin) activity using 3'-phosphotyrosine-containing 5'-[32P]-labeled single-stranded DNA oligonucleotide by ...


J Med Chem 58: 3997-4015 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00303
BindingDB Entry DOI: 10.7270/Q2DN46S6
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM50172717
PNG
(CHEMBL3809043)
Show SMILES CN(C)CCCn1c2-c3ccccc3C(=O)c2c2cnccc2c1=O
Show InChI InChI=1S/C20H19N3O2/c1-22(2)10-5-11-23-18-13-6-3-4-7-14(13)19(24)17(18)16-12-21-9-8-15(16)20(23)25/h3-4,6-9,12H,5,10-11H2,1-2H3
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n/an/a 3.70E+4n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TDP2 using 19-mer single stranded DNA containing 5'-phosphotyrosine as substrate after 15 mins by PAGE


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1


(Homo sapiens (Human))
BDBM50172725
PNG
(CHEMBL3809706)
Show SMILES Cl.Cl.NCCCn1c2-c3ccccc3C(=O)c2c2ncccc2c1=O
Show InChI InChI=1S/C18H15N3O2.2ClH/c19-8-4-10-21-16-11-5-1-2-6-12(11)17(22)14(16)15-13(18(21)23)7-3-9-20-15;;/h1-3,5-7,9H,4,8,10,19H2;2*1H
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n/an/a 4.30E+4n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of recombinant TDP1 (unknown origin) using single stranded 5'-[32P]-labeled DNA containing 3'-phosphotyrosine as substrate after 15 mins b...


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1


(Homo sapiens (Human))
BDBM50172724
PNG
(CHEMBL3809831)
Show SMILES Cl.Cl.NCCCn1c2-c3ccccc3C(=O)c2c2cccnc2c1=O
Show InChI InChI=1S/C18H15N3O2.2ClH/c19-8-4-10-21-16-11-5-1-2-6-12(11)17(22)14(16)13-7-3-9-20-15(13)18(21)23;;/h1-3,5-7,9H,4,8,10,19H2;2*1H
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n/an/a>6.00E+4n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of recombinant TDP1 (unknown origin) using single stranded 5'-[32P]-labeled DNA containing 3'-phosphotyrosine as substrate after 15 mins b...


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1


(Homo sapiens (Human))
BDBM50172717
PNG
(CHEMBL3809043)
Show SMILES CN(C)CCCn1c2-c3ccccc3C(=O)c2c2cnccc2c1=O
Show InChI InChI=1S/C20H19N3O2/c1-22(2)10-5-11-23-18-13-6-3-4-7-14(13)19(24)17(18)16-12-21-9-8-15(16)20(23)25/h3-4,6-9,12H,5,10-11H2,1-2H3
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n/an/a 6.30E+4n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of recombinant TDP1 (unknown origin) using single stranded 5'-[32P]-labeled DNA containing 3'-phosphotyrosine as substrate after 15 mins b...


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1


(Homo sapiens (Human))
BDBM50090918
PNG
(CHEMBL3581877)
Show SMILES CN(C)CCCn1c2-c3ccccc3C(=O)c2c2ccncc2c1=O
Show InChI InChI=1S/C20H19N3O2/c1-22(2)10-5-11-23-18-14-6-3-4-7-15(14)19(24)17(18)13-8-9-21-12-16(13)20(23)25/h3-4,6-9,12H,5,10-11H2,1-2H3
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n/an/a 6.30E+4n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of recombinant TDP1 (unknown origin) using single stranded 5'-[32P]-labeled DNA containing 3'-phosphotyrosine as substrate after 15 mins b...


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM50090918
PNG
(CHEMBL3581877)
Show SMILES CN(C)CCCn1c2-c3ccccc3C(=O)c2c2ccncc2c1=O
Show InChI InChI=1S/C20H19N3O2/c1-22(2)10-5-11-23-18-14-6-3-4-7-15(14)19(24)17(18)13-8-9-21-12-16(13)20(23)25/h3-4,6-9,12H,5,10-11H2,1-2H3
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n/an/a 8.00E+4n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TDP2 using 19-mer single stranded DNA containing 5'-phosphotyrosine as substrate after 15 mins by PAGE


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1


(Homo sapiens (Human))
BDBM50172685
PNG
(CHEMBL3809255)
Show SMILES CN(C)CCCn1c2-c3ccccc3C(=O)c2c2ncccc2c1=O
Show InChI InChI=1S/C20H19N3O2/c1-22(2)11-6-12-23-18-13-7-3-4-8-14(13)19(24)16(18)17-15(20(23)25)9-5-10-21-17/h3-5,7-10H,6,11-12H2,1-2H3
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n/an/a 9.00E+4n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of recombinant TDP1 (unknown origin) using single stranded 5'-[32P]-labeled DNA containing 3'-phosphotyrosine as substrate after 15 mins b...


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM50172715
PNG
(CHEMBL3808646)
Show SMILES Cl.Cl.NCCCn1c2-c3ccccc3C(=O)c2c2cnccc2c1=O
Show InChI InChI=1S/C18H15N3O2.2ClH/c19-7-3-9-21-16-11-4-1-2-5-12(11)17(22)15(16)14-10-20-8-6-13(14)18(21)23;;/h1-2,4-6,8,10H,3,7,9,19H2;2*1H
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n/an/a 1.11E+5n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TDP2 using 19-mer single stranded DNA containing 5'-phosphotyrosine as substrate after 15 mins by PAGE


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1


(Homo sapiens (Human))
BDBM50172713
PNG
(CHEMBL3809548)
Show SMILES OC[C@@H](O)Cn1c2-c3ccccc3C(=O)c2c2ccncc2c1=O
Show InChI InChI=1S/C18H14N2O4/c21-9-10(22)8-20-16-12-3-1-2-4-13(12)17(23)15(16)11-5-6-19-7-14(11)18(20)24/h1-7,10,21-22H,8-9H2/t10-/m0/s1
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n/an/a>1.11E+5n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of recombinant TDP1 (unknown origin) using single stranded 5'-[32P]-labeled DNA containing 3'-phosphotyrosine as substrate after 15 mins b...


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM50172718
PNG
(CHEMBL3808668)
Show SMILES O=C1c2ccccc2-c2c1c1cnccc1c(=O)n2CCCn1ccnc1
Show InChI InChI=1S/C21H16N4O2/c26-20-15-5-2-1-4-14(15)19-18(20)17-12-22-7-6-16(17)21(27)25(19)10-3-9-24-11-8-23-13-24/h1-2,4-8,11-13H,3,9-10H2
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n/an/a>1.11E+5n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TDP2 using 19-mer single stranded DNA containing 5'-phosphotyrosine as substrate after 15 mins by PAGE


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1


(Homo sapiens (Human))
BDBM50172711
PNG
(CHEMBL3808575)
Show SMILES O=C1c2ccccc2-c2c1c1cccnc1c(=O)n2CCCN1CCOCC1
Show InChI InChI=1S/C22H21N3O3/c26-21-16-6-2-1-5-15(16)20-18(21)17-7-3-8-23-19(17)22(27)25(20)10-4-9-24-11-13-28-14-12-24/h1-3,5-8H,4,9-14H2
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n/an/a>1.11E+5n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of recombinant TDP1 (unknown origin) using single stranded 5'-[32P]-labeled DNA containing 3'-phosphotyrosine as substrate after 15 mins b...


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1 (TDP1)


(Homo sapiens (Human))
BDBM50090917
PNG
(CHEMBL3581863)
Show SMILES OC[C@@H](O)Cn1c2-c3ccccc3C(=O)c2c2ccc(I)cc2c1=O
Show InChI InChI=1S/C19H14INO4/c20-10-5-6-12-15(7-10)19(25)21(8-11(23)9-22)17-13-3-1-2-4-14(13)18(24)16(12)17/h1-7,11,22-23H,8-9H2/t11-/m0/s1
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n/an/a>1.11E+5n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of recombinant TPD1 (unknown origin) activity using 3'-phosphotyrosine-containing 5'-[32P]-labeled single-stranded DNA oligonucleotide by ...


J Med Chem 58: 3997-4015 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00303
BindingDB Entry DOI: 10.7270/Q2DN46S6
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1


(Homo sapiens (Human))
BDBM50172694
PNG
(CHEMBL3809626)
Show SMILES OC[C@@H](O)Cn1c2-c3ccccc3C(=O)c2c2cccnc2c1=O
Show InChI InChI=1S/C18H14N2O4/c21-9-10(22)8-20-16-11-4-1-2-5-12(11)17(23)14(16)13-6-3-7-19-15(13)18(20)24/h1-7,10,21-22H,8-9H2/t10-/m0/s1
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n/an/a>1.11E+5n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of recombinant TDP1 (unknown origin) using single stranded 5'-[32P]-labeled DNA containing 3'-phosphotyrosine as substrate after 15 mins b...


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM50172705
PNG
(CHEMBL3809424)
Show SMILES CN(C)CCCn1c2-c3ccccc3C(=O)c2c2cccnc2c1=O
Show InChI InChI=1S/C20H19N3O2/c1-22(2)11-6-12-23-18-13-7-3-4-8-14(13)19(24)16(18)15-9-5-10-21-17(15)20(23)25/h3-5,7-10H,6,11-12H2,1-2H3
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n/an/a>1.11E+5n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TDP2 using 19-mer single stranded DNA containing 5'-phosphotyrosine as substrate after 15 mins by PAGE


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM50172694
PNG
(CHEMBL3809626)
Show SMILES OC[C@@H](O)Cn1c2-c3ccccc3C(=O)c2c2cccnc2c1=O
Show InChI InChI=1S/C18H14N2O4/c21-9-10(22)8-20-16-11-4-1-2-5-12(11)17(23)14(16)13-6-3-7-19-15(13)18(20)24/h1-7,10,21-22H,8-9H2/t10-/m0/s1
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n/an/a>1.11E+5n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TDP2 using 19-mer single stranded DNA containing 5'-phosphotyrosine as substrate after 15 mins by PAGE


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM50172725
PNG
(CHEMBL3809706)
Show SMILES Cl.Cl.NCCCn1c2-c3ccccc3C(=O)c2c2ncccc2c1=O
Show InChI InChI=1S/C18H15N3O2.2ClH/c19-8-4-10-21-16-11-5-1-2-6-12(11)17(22)14(16)15-13(18(21)23)7-3-9-20-15;;/h1-3,5-7,9H,4,8,10,19H2;2*1H
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n/an/a>1.11E+5n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TDP2 using 19-mer single stranded DNA containing 5'-phosphotyrosine as substrate after 15 mins by PAGE


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM50172722
PNG
(CHEMBL3581878)
Show SMILES O=C1c2ccccc2-c2c1c1ccncc1c(=O)n2CCCn1ccnc1
Show InChI InChI=1S/C21H16N4O2/c26-20-16-5-2-1-4-15(16)19-18(20)14-6-7-22-12-17(14)21(27)25(19)10-3-9-24-11-8-23-13-24/h1-2,4-8,11-13H,3,9-10H2
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n/an/a>1.11E+5n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TDP2 using 19-mer single stranded DNA containing 5'-phosphotyrosine as substrate after 15 mins by PAGE


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM50172719
PNG
(CHEMBL3810072)
Show SMILES O=C1c2ccccc2-c2c1c1cnccc1c(=O)n2CCCN1CCOCC1
Show InChI InChI=1S/C22H21N3O3/c26-21-16-5-2-1-4-15(16)20-19(21)18-14-23-7-6-17(18)22(27)25(20)9-3-8-24-10-12-28-13-11-24/h1-2,4-7,14H,3,8-13H2
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n/an/a>1.11E+5n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TDP2 using 19-mer single stranded DNA containing 5'-phosphotyrosine as substrate after 15 mins by PAGE


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM50172724
PNG
(CHEMBL3809831)
Show SMILES Cl.Cl.NCCCn1c2-c3ccccc3C(=O)c2c2cccnc2c1=O
Show InChI InChI=1S/C18H15N3O2.2ClH/c19-8-4-10-21-16-11-5-1-2-6-12(11)17(22)14(16)13-7-3-9-20-15(13)18(21)23;;/h1-3,5-7,9H,4,8,10,19H2;2*1H
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n/an/a>1.11E+5n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TDP2 using 19-mer single stranded DNA containing 5'-phosphotyrosine as substrate after 15 mins by PAGE


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM50172685
PNG
(CHEMBL3809255)
Show SMILES CN(C)CCCn1c2-c3ccccc3C(=O)c2c2ncccc2c1=O
Show InChI InChI=1S/C20H19N3O2/c1-22(2)11-6-12-23-18-13-7-3-4-8-14(13)19(24)16(18)17-15(20(23)25)9-5-10-21-17/h3-5,7-10H,6,11-12H2,1-2H3
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n/an/a>1.11E+5n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TDP2 using 19-mer single stranded DNA containing 5'-phosphotyrosine as substrate after 15 mins by PAGE


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM50172723
PNG
(CHEMBL3581876)
Show SMILES O=C1c2ccccc2-c2c1c1ccncc1c(=O)n2CCCN1CCOCC1
Show InChI InChI=1S/C22H21N3O3/c26-21-17-5-2-1-4-16(17)20-19(21)15-6-7-23-14-18(15)22(27)25(20)9-3-8-24-10-12-28-13-11-24/h1-2,4-7,14H,3,8-13H2
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n/an/a>1.11E+5n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TDP2 using 19-mer single stranded DNA containing 5'-phosphotyrosine as substrate after 15 mins by PAGE


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM50172692
PNG
(CHEMBL3809688)
Show SMILES OC[C@@H](O)Cn1c2-c3ccccc3C(=O)c2c2ncccc2c1=O
Show InChI InChI=1S/C18H14N2O4/c21-9-10(22)8-20-16-11-4-1-2-5-12(11)17(23)14(16)15-13(18(20)24)6-3-7-19-15/h1-7,10,21-22H,8-9H2/t10-/m0/s1
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n/an/a>1.11E+5n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TDP2 using 19-mer single stranded DNA containing 5'-phosphotyrosine as substrate after 15 mins by PAGE


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1


(Homo sapiens (Human))
BDBM50172719
PNG
(CHEMBL3810072)
Show SMILES O=C1c2ccccc2-c2c1c1cnccc1c(=O)n2CCCN1CCOCC1
Show InChI InChI=1S/C22H21N3O3/c26-21-16-5-2-1-4-15(16)20-19(21)18-14-23-7-6-17(18)22(27)25(20)9-3-8-24-10-12-28-13-11-24/h1-2,4-7,14H,3,8-13H2
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n/an/a>1.11E+5n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of recombinant TDP1 (unknown origin) using single stranded 5'-[32P]-labeled DNA containing 3'-phosphotyrosine as substrate after 15 mins b...


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM50172498
PNG
(CHEMBL3810067)
Show SMILES O=C1c2ccccc2-c2c1c1ncccc1c(=O)n2CCCN1CCOCC1
Show InChI InChI=1S/C22H21N3O3/c26-21-16-6-2-1-5-15(16)20-18(21)19-17(7-3-8-23-19)22(27)25(20)10-4-9-24-11-13-28-14-12-24/h1-3,5-8H,4,9-14H2
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n/an/a>1.11E+5n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TDP2 using 19-mer single stranded DNA containing 5'-phosphotyrosine as substrate after 15 mins by PAGE


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM50172654
PNG
(CHEMBL3809052)
Show SMILES O=C1c2ccccc2-c2c1c1ncccc1c(=O)n2CCCn1ccnc1
Show InChI InChI=1S/C21H16N4O2/c26-20-15-6-2-1-5-14(15)19-17(20)18-16(7-3-8-23-18)21(27)25(19)11-4-10-24-12-9-22-13-24/h1-3,5-9,12-13H,4,10-11H2
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n/an/a>1.11E+5n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TDP2 using 19-mer single stranded DNA containing 5'-phosphotyrosine as substrate after 15 mins by PAGE


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1


(Homo sapiens (Human))
BDBM50172722
PNG
(CHEMBL3581878)
Show SMILES O=C1c2ccccc2-c2c1c1ccncc1c(=O)n2CCCn1ccnc1
Show InChI InChI=1S/C21H16N4O2/c26-20-16-5-2-1-4-15(16)19-18(20)14-6-7-22-12-17(14)21(27)25(19)10-3-9-24-11-8-23-13-24/h1-2,4-8,11-13H,3,9-10H2
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n/an/a>1.11E+5n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of recombinant TDP1 (unknown origin) using single stranded 5'-[32P]-labeled DNA containing 3'-phosphotyrosine as substrate after 15 mins b...


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1


(Homo sapiens (Human))
BDBM50172723
PNG
(CHEMBL3581876)
Show SMILES O=C1c2ccccc2-c2c1c1ccncc1c(=O)n2CCCN1CCOCC1
Show InChI InChI=1S/C22H21N3O3/c26-21-17-5-2-1-4-16(17)20-19(21)15-6-7-23-14-18(15)22(27)25(20)9-3-8-24-10-12-28-13-11-24/h1-2,4-7,14H,3,8-13H2
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n/an/a>1.11E+5n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of recombinant TDP1 (unknown origin) using single stranded 5'-[32P]-labeled DNA containing 3'-phosphotyrosine as substrate after 15 mins b...


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1


(Homo sapiens (Human))
BDBM50172718
PNG
(CHEMBL3808668)
Show SMILES O=C1c2ccccc2-c2c1c1cnccc1c(=O)n2CCCn1ccnc1
Show InChI InChI=1S/C21H16N4O2/c26-20-15-5-2-1-4-14(15)19-18(20)17-12-22-7-6-16(17)21(27)25(19)10-3-9-24-11-8-23-13-24/h1-2,4-8,11-13H,3,9-10H2
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n/an/a>1.11E+5n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of recombinant TDP1 (unknown origin) using single stranded 5'-[32P]-labeled DNA containing 3'-phosphotyrosine as substrate after 15 mins b...


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1


(Homo sapiens (Human))
BDBM50179183
PNG
(CHEMBL576840 | NSC-3198)
Show SMILES OC(=O)C(CSSCC(NC(=O)Cc1ccccc1)C(O)=O)NC(=O)Cc1ccccc1
Show InChI InChI=1S/C22H24N2O6S2/c25-19(11-15-7-3-1-4-8-15)23-17(21(27)28)13-31-32-14-18(22(29)30)24-20(26)12-16-9-5-2-6-10-16/h1-10,17-18H,11-14H2,(H,23,25)(H,24,26)(H,27,28)(H,29,30)
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n/an/a>1.11E+5n/an/an/an/an/an/a



Georgia State University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TDP1 using 5'-[32P]-labeled N14Y as substrate after 15 mins by PAGE method


Bioorg Med Chem Lett 26: 3232-3236 (2016)


Article DOI: 10.1016/j.bmcl.2016.05.065
BindingDB Entry DOI: 10.7270/Q22809HF
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1


(Homo sapiens (Human))
BDBM50179184
PNG
(CHEMBL264425)
Show SMILES OC(=O)C(CSSCC(NC(=O)c1ccccc1)C(O)=O)NC(=O)c1ccccc1
Show InChI InChI=1S/C20H20N2O6S2/c23-17(13-7-3-1-4-8-13)21-15(19(25)26)11-29-30-12-16(20(27)28)22-18(24)14-9-5-2-6-10-14/h1-10,15-16H,11-12H2,(H,21,23)(H,22,24)(H,25,26)(H,27,28)
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n/an/a>1.11E+5n/an/an/an/an/an/a



Georgia State University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TDP1 using 5'-[32P]-labeled N14Y as substrate after 15 mins by PAGE method


Bioorg Med Chem Lett 26: 3232-3236 (2016)


Article DOI: 10.1016/j.bmcl.2016.05.065
BindingDB Entry DOI: 10.7270/Q22809HF
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1


(Homo sapiens (Human))
BDBM50179250
PNG
(CHEMBL3813826)
Show SMILES OC(=O)C1=NN(C(=O)\C1=C/c1ccc(cc1)N(CCC#N)CCC#N)c1ccc(cc1)S(O)(=O)=O
Show InChI InChI=1S/C23H19N5O6S/c24-11-1-13-27(14-2-12-25)17-5-3-16(4-6-17)15-20-21(23(30)31)26-28(22(20)29)18-7-9-19(10-8-18)35(32,33)34/h3-10,15H,1-2,13-14H2,(H,30,31)(H,32,33,34)/b20-15-
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n/an/a>1.11E+5n/an/an/an/an/an/a



Georgia State University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TDP1 using 5'-[32P]-labeled N14Y as substrate after 15 mins by PAGE method


Bioorg Med Chem Lett 26: 3232-3236 (2016)


Article DOI: 10.1016/j.bmcl.2016.05.065
BindingDB Entry DOI: 10.7270/Q22809HF
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM50172711
PNG
(CHEMBL3808575)
Show SMILES O=C1c2ccccc2-c2c1c1cccnc1c(=O)n2CCCN1CCOCC1
Show InChI InChI=1S/C22H21N3O3/c26-21-16-6-2-1-5-15(16)20-18(21)17-7-3-8-23-19(17)22(27)25(20)10-4-9-24-11-13-28-14-12-24/h1-3,5-8H,4,9-14H2
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n/an/a>1.11E+5n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TDP2 using 19-mer single stranded DNA containing 5'-phosphotyrosine as substrate after 15 mins by PAGE


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1


(Homo sapiens (Human))
BDBM50172692
PNG
(CHEMBL3809688)
Show SMILES OC[C@@H](O)Cn1c2-c3ccccc3C(=O)c2c2ncccc2c1=O
Show InChI InChI=1S/C18H14N2O4/c21-9-10(22)8-20-16-11-4-1-2-5-12(11)17(23)14(16)15-13(18(20)24)6-3-7-19-15/h1-7,10,21-22H,8-9H2/t10-/m0/s1
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n/an/a>1.11E+5n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of recombinant TDP1 (unknown origin) using single stranded 5'-[32P]-labeled DNA containing 3'-phosphotyrosine as substrate after 15 mins b...


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2 (mTDP2 WT)


(Mus musculus (Mouse))
BDBM50179183
PNG
(CHEMBL576840 | NSC-3198)
Show SMILES OC(=O)C(CSSCC(NC(=O)Cc1ccccc1)C(O)=O)NC(=O)Cc1ccccc1
Show InChI InChI=1S/C22H24N2O6S2/c25-19(11-15-7-3-1-4-8-15)23-17(21(27)28)13-31-32-14-18(22(29)30)24-20(26)12-16-9-5-2-6-10-16/h1-10,17-18H,11-14H2,(H,23,25)(H,24,26)(H,27,28)(H,29,30)
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n/an/a>1.11E+5n/an/an/an/an/an/a



Georgia State University

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant TDP2 using alpha32P-cordycepin-3'-labeled TY19 as substrate after 15 mins by PAGE method


Bioorg Med Chem Lett 26: 3232-3236 (2016)


Article DOI: 10.1016/j.bmcl.2016.05.065
BindingDB Entry DOI: 10.7270/Q22809HF
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2 (mTDP2 WT)


(Mus musculus (Mouse))
BDBM50179184
PNG
(CHEMBL264425)
Show SMILES OC(=O)C(CSSCC(NC(=O)c1ccccc1)C(O)=O)NC(=O)c1ccccc1
Show InChI InChI=1S/C20H20N2O6S2/c23-17(13-7-3-1-4-8-13)21-15(19(25)26)11-29-30-12-16(20(27)28)22-18(24)14-9-5-2-6-10-14/h1-10,15-16H,11-12H2,(H,21,23)(H,22,24)(H,25,26)(H,27,28)
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n/an/a>1.11E+5n/an/an/an/an/an/a



Georgia State University

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant TDP2 using alpha32P-cordycepin-3'-labeled TY19 as substrate after 15 mins by PAGE method


Bioorg Med Chem Lett 26: 3232-3236 (2016)


Article DOI: 10.1016/j.bmcl.2016.05.065
BindingDB Entry DOI: 10.7270/Q22809HF
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1


(Homo sapiens (Human))
BDBM50172654
PNG
(CHEMBL3809052)
Show SMILES O=C1c2ccccc2-c2c1c1ncccc1c(=O)n2CCCn1ccnc1
Show InChI InChI=1S/C21H16N4O2/c26-20-15-6-2-1-5-14(15)19-17(20)18-16(7-3-8-23-18)21(27)25(19)11-4-10-24-12-9-22-13-24/h1-3,5-9,12-13H,4,10-11H2
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n/an/a>1.11E+5n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of recombinant TDP1 (unknown origin) using single stranded 5'-[32P]-labeled DNA containing 3'-phosphotyrosine as substrate after 15 mins b...


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 1


(Homo sapiens (Human))
BDBM50172498
PNG
(CHEMBL3810067)
Show SMILES O=C1c2ccccc2-c2c1c1ncccc1c(=O)n2CCCN1CCOCC1
Show InChI InChI=1S/C22H21N3O3/c26-21-16-6-2-1-5-15(16)20-18(21)19-17(7-3-8-23-19)22(27)25(20)10-4-9-24-11-13-28-14-12-24/h1-3,5-8H,4,9-14H2
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n/an/a>1.11E+5n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of recombinant TDP1 (unknown origin) using single stranded 5'-[32P]-labeled DNA containing 3'-phosphotyrosine as substrate after 15 mins b...


J Med Chem 59: 3840-53 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00003
BindingDB Entry DOI: 10.7270/Q2959KFD
More data for this
Ligand-Target Pair
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