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Patent code US10617706

Compile Data Set for Download or QSAR
Found 43 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437709
PNG
(US10617706, Example 143)
Show SMILES OB(O)c1cccc(c1)N1C2NC(=O)N(C(=O)C2=Cc2ccc(cc12)C#N)c1ccc(Cl)cc1
Show InChI InChI=1S/C24H16BClN4O4/c26-17-6-8-18(9-7-17)30-23(31)20-11-15-5-4-14(13-27)10-21(15)29(22(20)28-24(30)32)19-3-1-2-16(12-19)25(33)34/h1-12,22,33-34H,(H,28,32)
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n/an/a 3.85n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437686
PNG
(US10617706, Example 120)
Show SMILES OB(O)c1cccc(Oc2ccc(cc2)N2C3NC(=O)NC(=O)C3=Cc3ccc(cc23)C#N)c1
Show InChI InChI=1S/C24H17BN4O5/c26-13-14-4-5-15-11-20-22(27-24(31)28-23(20)30)29(21(15)10-14)17-6-8-18(9-7-17)34-19-3-1-2-16(12-19)25(32)33/h1-12,22,32-33H,(H2,27,28,30,31)
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n/an/a 5.01n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437707
PNG
(US10617706, Example 141)
Show SMILES CS(=O)(=O)Nc1cccc(c1)N1C2NC(=O)N(C(=O)C2=Cc2ccc(cc12)C#N)c1ccc(Cl)cc1
Show InChI InChI=1S/C25H18ClN5O4S/c1-36(34,35)29-18-3-2-4-20(13-18)30-22-11-15(14-27)5-6-16(22)12-21-23(30)28-25(33)31(24(21)32)19-9-7-17(26)8-10-19/h2-13,23,29H,1H3,(H,28,33)
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n/an/a 6.09n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437708
PNG
(US10617706, Example 142)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)N1C2NC(=O)N(C(=O)C2=Cc2ccc(cc12)C#N)c1ccc(Cl)cc1
Show InChI InChI=1S/C25H18ClN5O4S/c1-36(34,35)29-18-6-10-19(11-7-18)30-22-12-15(14-27)2-3-16(22)13-21-23(30)28-25(33)31(24(21)32)20-8-4-17(26)5-9-20/h2-13,23,29H,1H3,(H,28,33)
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n/an/a 6.49n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437703
PNG
(US10617706, Example 137)
Show SMILES Oc1cccc(c1)N1C2NC(=O)N(C(=O)C2=Cc2ccc(cc12)C#N)c1ccc(Cl)cc1
Show InChI InChI=1S/C24H15ClN4O3/c25-16-6-8-17(9-7-16)29-23(31)20-11-15-5-4-14(13-26)10-21(15)28(22(20)27-24(29)32)18-2-1-3-19(30)12-18/h1-12,22,30H,(H,27,32)
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n/an/a 7.25n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437685
PNG
(US10617706, Example 119)
Show SMILES CC1(C)OB(OC1(C)C)c1cccc(Oc2ccc(cc2)N2C3NC(=O)NC(=O)C3=Cc3ccc(cc23)C#N)c1
Show InChI InChI=1S/C30H27BN4O5/c1-29(2)30(3,4)40-31(39-29)20-6-5-7-23(16-20)38-22-12-10-21(11-13-22)35-25-14-18(17-32)8-9-19(25)15-24-26(35)33-28(37)34-27(24)36/h5-16,26H,1-4H3,(H2,33,34,36,37)
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n/an/a 8.28n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437705
PNG
(US10617706, Example 139)
Show SMILES Oc1cccc(c1)N1C2NC(=O)N(C(=O)C2=Cc2ccc(cc12)C#N)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C24H14Cl2N4O3/c25-19-7-6-16(11-20(19)26)30-23(32)18-9-14-5-4-13(12-27)8-21(14)29(22(18)28-24(30)33)15-2-1-3-17(31)10-15/h1-11,22,31H,(H,28,33)
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n/an/a 13.6n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437704
PNG
(US10617706, Example 138)
Show SMILES Oc1cccc(c1)N1C2NC(=O)N(C(=O)C2=Cc2ccc(cc12)C#N)c1cccc(Cl)c1
Show InChI InChI=1S/C24H15ClN4O3/c25-16-3-1-4-17(11-16)29-23(31)20-10-15-8-7-14(13-26)9-21(15)28(22(20)27-24(29)32)18-5-2-6-19(30)12-18/h1-12,22,30H,(H,27,32)
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n/an/a 19.8n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437694
PNG
(US10617706, Example 128)
Show SMILES Oc1ccc(cc1)N1C2NC(=O)N(C(=O)C2=Cc2ccc(cc12)C#N)c1ccc(Cl)cc1
Show InChI InChI=1S/C24H15ClN4O3/c25-16-3-5-18(6-4-16)29-23(31)20-12-15-2-1-14(13-26)11-21(15)28(22(20)27-24(29)32)17-7-9-19(30)10-8-17/h1-12,22,30H,(H,27,32)
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n/an/a 32.8n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437692
PNG
(US10617706, Example 126)
Show SMILES Oc1ccc(cc1)N1C2NC(=O)N(C(=O)C2=Cc2ccc(cc12)C#N)c1ccccc1
Show InChI InChI=1S/C24H16N4O3/c25-14-15-6-7-16-13-20-22(27(21(16)12-15)18-8-10-19(29)11-9-18)26-24(31)28(23(20)30)17-4-2-1-3-5-17/h1-13,22,29H,(H,26,31)
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n/an/a 33.1n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437697
PNG
(US10617706, Example 131)
Show SMILES NC(=O)c1cccc(c1)N1C(=O)NC2N(c3ccc(O)cc3)c3cc(ccc3C=C2C1=O)C#N
Show InChI InChI=1S/C25H17N5O4/c26-13-14-4-5-15-12-20-23(29(21(15)10-14)17-6-8-19(31)9-7-17)28-25(34)30(24(20)33)18-3-1-2-16(11-18)22(27)32/h1-12,23,31H,(H2,27,32)(H,28,34)
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n/an/a 35n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437696
PNG
(US10617706, Example 130)
Show SMILES COC(=O)c1cccc(c1)N1C(=O)NC2N(c3ccc(O)cc3)c3cc(ccc3C=C2C1=O)C#N
Show InChI InChI=1S/C26H18N4O5/c1-35-25(33)17-3-2-4-19(12-17)30-24(32)21-13-16-6-5-15(14-27)11-22(16)29(23(21)28-26(30)34)18-7-9-20(31)10-8-18/h2-13,23,31H,1H3,(H,28,34)
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n/an/a 38n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437689
PNG
(US10617706, Example 123)
Show SMILES OB(O)c1cccc(COc2ccc(cc2)N2C3NC(=O)NC(=O)C3=Cc3ccc(cc23)C#N)c1
Show InChI InChI=1S/C25H19BN4O5/c27-13-15-4-5-17-12-21-23(28-25(32)29-24(21)31)30(22(17)11-15)19-6-8-20(9-7-19)35-14-16-2-1-3-18(10-16)26(33)34/h1-12,23,33-34H,14H2,(H2,28,29,31,32)
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n/an/a 39n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437687
PNG
(US10617706, Example 121)
Show SMILES CC1(C)OB(OC1(C)C)c1cccc(COc2ccc(cc2)N2C3NC(=O)NC(=O)C3=Cc3ccc(cc23)C#N)c1
Show InChI InChI=1S/C31H29BN4O5/c1-30(2)31(3,4)41-32(40-30)22-7-5-6-20(14-22)18-39-24-12-10-23(11-13-24)36-26-15-19(17-33)8-9-21(26)16-25-27(36)34-29(38)35-28(25)37/h5-16,27H,18H2,1-4H3,(H2,34,35,37,38)
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n/an/a 47n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437699
PNG
(US10617706, Example 133)
Show SMILES Oc1ccc(cc1)N1C2NC(=O)N(C(=O)C2=Cc2ccc(cc12)C#N)c1ccc(NC(=O)Oc2ccccc2)cc1
Show InChI InChI=1S/C31H21N5O5/c32-18-19-6-7-20-17-26-28(35(27(20)16-19)22-12-14-24(37)15-13-22)34-30(39)36(29(26)38)23-10-8-21(9-11-23)33-31(40)41-25-4-2-1-3-5-25/h1-17,28,37H,(H,33,40)(H,34,39)
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n/an/a 59n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437695
PNG
(US10617706, Example 129)
Show SMILES Oc1ccc(cc1)N1C2NC(=O)N(C(=O)C2=Cc2ccc(cc12)C#N)c1ccc(Br)cc1
Show InChI InChI=1S/C24H15BrN4O3/c25-16-3-5-18(6-4-16)29-23(31)20-12-15-2-1-14(13-26)11-21(15)28(22(20)27-24(29)32)17-7-9-19(30)10-8-17/h1-12,22,30H,(H,27,32)
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n/an/a 64.7n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437693
PNG
(US10617706, Example 127)
Show SMILES Oc1ccc(cc1)N1C2NC(=O)N(C(=O)C2=Cc2ccc(cc12)C#N)c1ccc(F)cc1
Show InChI InChI=1S/C24H15FN4O3/c25-16-3-5-18(6-4-16)29-23(31)20-12-15-2-1-14(13-26)11-21(15)28(22(20)27-24(29)32)17-7-9-19(30)10-8-17/h1-12,22,30H,(H,27,32)
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n/an/a 70.4n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437698
PNG
(US10617706, Example 132)
Show SMILES Oc1ccc(cc1)N1C2NC(=O)N(C(=O)C2=Cc2ccc(cc12)C#N)c1cccc(NC(=O)Oc2ccccc2)c1
Show InChI InChI=1S/C31H21N5O5/c32-18-19-9-10-20-16-26-28(35(27(20)15-19)22-11-13-24(37)14-12-22)34-30(39)36(29(26)38)23-6-4-5-21(17-23)33-31(40)41-25-7-2-1-3-8-25/h1-17,28,37H,(H,33,40)(H,34,39)
PDB

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n/an/a 119n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437702
PNG
(US10617706, Example 136)
Show SMILES Oc1ccc(cc1)N1C2NC(=O)N(C(=O)C2=Cc2ccc(cc12)C#N)c1ccc(CNP(=O)(Oc2ccccc2)Oc2ccccc2)cc1
Show InChI InChI=1S/C37H28N5O6P/c38-23-26-11-14-27-22-33-35(41(34(27)21-26)28-17-19-30(43)20-18-28)40-37(45)42(36(33)44)29-15-12-25(13-16-29)24-39-49(46,47-31-7-3-1-4-8-31)48-32-9-5-2-6-10-32/h1-22,35,43H,24H2,(H,39,46)(H,40,45)
PDB

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n/an/a 119n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437683
PNG
(US10617706, Example 117)
Show SMILES OC(=O)c1cccc(COc2ccc(cc2)N2C3NC(=O)NC(=O)C3=Cc3ccc(cc23)C#N)c1
Show InChI InChI=1S/C26H18N4O5/c27-13-15-4-5-17-12-21-23(28-26(34)29-24(21)31)30(22(17)11-15)19-6-8-20(9-7-19)35-14-16-2-1-3-18(10-16)25(32)33/h1-12,23H,14H2,(H,32,33)(H2,28,29,31,34)
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n/an/a 131n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437682
PNG
(US10617706, Example 116)
Show SMILES COC(=O)c1cccc(COc2ccc(cc2)N2C3NC(=O)NC(=O)C3=Cc3ccc(cc23)C#N)c1
Show InChI InChI=1S/C27H20N4O5/c1-35-26(33)19-4-2-3-17(11-19)15-36-21-9-7-20(8-10-21)31-23-12-16(14-28)5-6-18(23)13-22-24(31)29-27(34)30-25(22)32/h2-13,24H,15H2,1H3,(H2,29,30,32,34)
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n/an/a 153n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437701
PNG
(US10617706, Example 135)
Show SMILES Oc1ccc(cc1)N1C2NC(=O)N(C(=O)C2=Cc2ccc(cc12)C#N)c1ccc(NP(=O)(Oc2ccccc2)Oc2ccccc2)cc1
Show InChI InChI=1S/C36H26N5O6P/c37-23-24-11-12-25-22-32-34(40(33(25)21-24)27-17-19-29(42)20-18-27)38-36(44)41(35(32)43)28-15-13-26(14-16-28)39-48(45,46-30-7-3-1-4-8-30)47-31-9-5-2-6-10-31/h1-22,34,42H,(H,38,44)(H,39,45)
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n/an/a 185n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437675
PNG
(US10617706, Example 109 | US10617706, Example 110)
Show SMILES OC(=O)c1cccc(Oc2ccc(cc2)N2C3NC(=O)NC(=O)C3=Cc3ccc(cc23)C#N)c1
Show InChI InChI=1S/C25H16N4O5/c26-13-14-4-5-15-12-20-22(27-25(33)28-23(20)30)29(21(15)10-14)17-6-8-18(9-7-17)34-19-3-1-2-16(11-19)24(31)32/h1-12,22H,(H,31,32)(H2,27,28,30,33)
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n/an/a 186n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437677
PNG
(US10617706, Example 111)
Show SMILES O=C1NC2N(c3ccc(OCc4ccccc4)cc3)c3cc(ccc3C=C2C(=O)N1)C#N
Show InChI InChI=1S/C25H18N4O3/c26-14-17-6-7-18-13-21-23(27-25(31)28-24(21)30)29(22(18)12-17)19-8-10-20(11-9-19)32-15-16-4-2-1-3-5-16/h1-13,23H,15H2,(H2,27,28,30,31)
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n/an/a 196n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437690
PNG
(US10617706, Example 124)
Show SMILES OB(O)c1ccc(COc2ccc(cc2)N2C3NC(=O)NC(=O)C3=Cc3ccc(cc23)C#N)cc1
Show InChI InChI=1S/C25H19BN4O5/c27-13-16-1-4-17-12-21-23(28-25(32)29-24(21)31)30(22(17)11-16)19-7-9-20(10-8-19)35-14-15-2-5-18(6-3-15)26(33)34/h1-12,23,33-34H,14H2,(H2,28,29,31,32)
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n/an/a 239n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437706
PNG
(US10617706, Example 140)
Show SMILES Clc1ccc(cc1)N1C(=O)NC2N(c3ccccc3)c3cc(ccc3C=C2C1=O)C#N
Show InChI InChI=1S/C24H15ClN4O2/c25-17-8-10-19(11-9-17)29-23(30)20-13-16-7-6-15(14-26)12-21(16)28(22(20)27-24(29)31)18-4-2-1-3-5-18/h1-13,22H,(H,27,31)
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n/an/a 274n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437700
PNG
(US10617706, Example 134)
Show SMILES Oc1ccc(cc1)N1C2NC(=O)N(C(=O)C2=Cc2ccc(cc12)C#N)c1cccc(NP(=O)(Oc2ccccc2)Oc2ccccc2)c1
Show InChI InChI=1S/C36H26N5O6P/c37-23-24-14-15-25-21-32-34(40(33(25)20-24)27-16-18-29(42)19-17-27)38-36(44)41(35(32)43)28-9-7-8-26(22-28)39-48(45,46-30-10-3-1-4-11-30)47-31-12-5-2-6-13-31/h1-22,34,42H,(H,38,44)(H,39,45)
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n/an/a 277n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437672
PNG
(US10617706, Example 106)
Show SMILES O=C1NC2N(c3cccc(Oc4ccccc4)c3)c3cc(ccc3C=C2C(=O)N1)C#N
Show InChI InChI=1S/C24H16N4O3/c25-14-15-9-10-16-12-20-22(26-24(30)27-23(20)29)28(21(16)11-15)17-5-4-8-19(13-17)31-18-6-2-1-3-7-18/h1-13,22H,(H2,26,27,29,30)
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n/an/a 301n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437691
PNG
(US10617706, Example 125)
Show SMILES CN1C(=O)NC2N(c3ccc(O)cc3)c3cc(ccc3C=C2C1=O)C#N
Show InChI InChI=1S/C19H14N4O3/c1-22-18(25)15-9-12-3-2-11(10-20)8-16(12)23(17(15)21-19(22)26)13-4-6-14(24)7-5-13/h2-9,17,24H,1H3,(H,21,26)
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n/an/a 317n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437688
PNG
(US10617706, Example 122)
Show SMILES CC1(C)OB(OC1(C)C)c1ccc(COc2ccc(cc2)N2C3NC(=O)NC(=O)C3=Cc3ccc(cc23)C#N)cc1
Show InChI InChI=1S/C31H29BN4O5/c1-30(2)31(3,4)41-32(40-30)22-9-6-19(7-10-22)18-39-24-13-11-23(12-14-24)36-26-15-20(17-33)5-8-21(26)16-25-27(36)34-29(38)35-28(25)37/h5-16,27H,18H2,1-4H3,(H2,34,35,37,38)
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n/an/a 359n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437678
PNG
(US10617706, Example 112)
Show SMILES O=C1NC2N(c3cccc(OCc4ccccc4)c3)c3cc(ccc3C=C2C(=O)N1)C#N
Show InChI InChI=1S/C25H18N4O3/c26-14-17-9-10-18-12-21-23(27-25(31)28-24(21)30)29(22(18)11-17)19-7-4-8-20(13-19)32-15-16-5-2-1-3-6-16/h1-13,23H,15H2,(H2,27,28,30,31)
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n/an/a 383n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437684
PNG
(US10617706, Example 118)
Show SMILES O=C(Nc1ccc(Oc2ccc(cc2)N2C3NC(=O)NC(=O)C3=Cc3ccc(cc23)C#N)cc1)Oc1ccccc1
Show InChI InChI=1S/C31H21N5O5/c32-18-19-6-7-20-17-26-28(34-30(38)35-29(26)37)36(27(20)16-19)22-10-14-25(15-11-22)40-24-12-8-21(9-13-24)33-31(39)41-23-4-2-1-3-5-23/h1-17,28H,(H,33,39)(H2,34,35,37,38)
PDB

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n/an/a 795n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437668
PNG
(US10617706, Example 102)
Show SMILES FC(F)Oc1ccc(cc1)N1C2NC(=O)NC(=O)C2=Cc2ccc(cc12)C#N
Show InChI InChI=1S/C19H12F2N4O3/c20-18(21)28-13-5-3-12(4-6-13)25-15-7-10(9-22)1-2-11(15)8-14-16(25)23-19(27)24-17(14)26/h1-8,16,18H,(H2,23,24,26,27)
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n/an/a 880n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437675
PNG
(US10617706, Example 109 | US10617706, Example 110)
Show SMILES OC(=O)c1cccc(Oc2ccc(cc2)N2C3NC(=O)NC(=O)C3=Cc3ccc(cc23)C#N)c1
Show InChI InChI=1S/C25H16N4O5/c26-13-14-4-5-15-12-20-22(27-25(33)28-23(20)30)29(21(15)10-14)17-6-8-18(9-7-17)34-19-3-1-2-16(11-19)24(31)32/h1-12,22H,(H,31,32)(H2,27,28,30,33)
PDB

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n/an/a 934n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437669
PNG
(US10617706, Example 103)
Show SMILES O=C1NC2N(c3ccc4OCOc4c3)c3cc(ccc3C=C2C(=O)N1)C#N
Show InChI InChI=1S/C19H12N4O4/c20-8-10-1-2-11-6-13-17(21-19(25)22-18(13)24)23(14(11)5-10)12-3-4-15-16(7-12)27-9-26-15/h1-7,17H,9H2,(H2,21,22,24,25)
PDB

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n/an/a 964n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437681
PNG
(US10617706, Example 115)
Show SMILES Clc1cccc(COc2ccc(cc2)N2C3NC(=O)NC(=O)C3=Cc3ccc(cc23)C#N)c1
Show InChI InChI=1S/C25H17ClN4O3/c26-18-3-1-2-16(10-18)14-33-20-8-6-19(7-9-20)30-22-11-15(13-27)4-5-17(22)12-21-23(30)28-25(32)29-24(21)31/h1-12,23H,14H2,(H2,28,29,31,32)
PDB

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n/an/a 993n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437664
PNG
(US10617706, Example 101)
Show SMILES FC(F)(F)Oc1ccc(cc1)N1C2NC(=O)NC(=O)C2=Cc2ccc(cc12)C#N
Show InChI InChI=1S/C19H11F3N4O3/c20-19(21,22)29-13-5-3-12(4-6-13)26-15-7-10(9-23)1-2-11(15)8-14-16(26)24-18(28)25-17(14)27/h1-8,16H,(H2,24,25,27,28)
PDB

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n/an/a 1.03E+3n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437671
PNG
(US10617706, Example 105)
Show SMILES O=C1NC2N(c3ccc(Oc4ccccc4)cc3)c3cc(ccc3C=C2C(=O)N1)C#N
Show InChI InChI=1S/C24H16N4O3/c25-14-15-6-7-16-13-20-22(26-24(30)27-23(20)29)28(21(16)12-15)17-8-10-19(11-9-17)31-18-4-2-1-3-5-18/h1-13,22H,(H2,26,27,29,30)
PDB

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n/an/a 1.13E+3n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437680
PNG
(US10617706, Example 114)
Show SMILES Brc1ccc(COc2ccc(cc2)N2C3NC(=O)NC(=O)C3=Cc3ccc(cc23)C#N)cc1
Show InChI InChI=1S/C25H17BrN4O3/c26-18-5-2-15(3-6-18)14-33-20-9-7-19(8-10-20)30-22-11-16(13-27)1-4-17(22)12-21-23(30)28-25(32)29-24(21)31/h1-12,23H,14H2,(H2,28,29,31,32)
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n/an/a 1.31E+3n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437670
PNG
(US10617706, Example 104)
Show SMILES FC1(F)Oc2ccc(cc2O1)N1C2NC(=O)NC(=O)C2=Cc2ccc(cc12)C#N
Show InChI InChI=1S/C19H10F2N4O4/c20-19(21)28-14-4-3-11(7-15(14)29-19)25-13-5-9(8-22)1-2-10(13)6-12-16(25)23-18(27)24-17(12)26/h1-7,16H,(H2,23,24,26,27)
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n/an/a 1.53E+3n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437679
PNG
(US10617706, Example 113)
Show SMILES Clc1ccc(COc2ccc(cc2)N2C3NC(=O)NC(=O)C3=Cc3ccc(cc23)C#N)cc1
Show InChI InChI=1S/C25H17ClN4O3/c26-18-5-2-15(3-6-18)14-33-20-9-7-19(8-10-20)30-22-11-16(13-27)1-4-17(22)12-21-23(30)28-25(32)29-24(21)31/h1-12,23H,14H2,(H2,28,29,31,32)
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n/an/a 1.60E+3n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437673
PNG
(US10617706, Example 107)
Show SMILES Fc1ccc(Oc2ccc(cc2)N2C3NC(=O)NC(=O)C3=Cc3ccc(cc23)C#N)cc1
Show InChI InChI=1S/C24H15FN4O3/c25-16-3-7-18(8-4-16)32-19-9-5-17(6-10-19)29-21-11-14(13-26)1-2-15(21)12-20-22(29)27-24(31)28-23(20)30/h1-12,22H,(H2,27,28,30,31)
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n/an/a 3.80E+3n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
Tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM437674
PNG
(US10617706, Example 108)
Show SMILES Clc1ccc(Oc2ccc(cc2)N2C3NC(=O)NC(=O)C3=Cc3ccc(cc23)C#N)cc1
Show InChI InChI=1S/C24H15ClN4O3/c25-16-3-7-18(8-4-16)32-19-9-5-17(6-10-19)29-21-11-14(13-26)1-2-15(21)12-20-22(29)27-24(31)28-23(20)30/h1-12,22H,(H2,27,28,30,31)
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n/an/a>1.00E+4n/an/an/an/an/an/a



REGENTS OF THE UNIVERSITY OF MINNESOTA; THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES

US Patent


Assay Description
The enzymatic activity of TDP2 was measured with a SUMO hTDP2cat fluorescence-based biochemical assay. To a black 384-well plate, 10 μL of compo...


US Patent US10617706 (2020)

More data for this
Ligand-Target Pair
* indicates data uncertainty>20%