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Compile Data Set for Download or QSAR

Found 193 hits of ic50 data for polymerid = 8407   
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
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50242631
PNG
(CHEMBL4068366)
Show SMILES NC(=O)c1cccc(NC(=O)\C=C/C(=O)N2CCN(CC2)c2ccc(Cl)cc2)c1
Show InChI InChI=1S/C21H21ClN4O3/c22-16-4-6-18(7-5-16)25-10-12-26(13-11-25)20(28)9-8-19(27)24-17-3-1-2-15(14-17)21(23)29/h1-9,14H,10-13H2,(H2,23,29)(H,24,27)/b9-8-
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n/an/a 160n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant His6-tagged PARP14 catalytic domain (unknown origin) expressed in Escherichia coli BL21(DE3) by fluorescence ba...


Bioorg Med Chem Lett 28: 2050-2054 (2018)

More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50242631
PNG
(CHEMBL4068366)
Show SMILES NC(=O)c1cccc(NC(=O)\C=C/C(=O)N2CCN(CC2)c2ccc(Cl)cc2)c1
Show InChI InChI=1S/C21H21ClN4O3/c22-16-4-6-18(7-5-16)25-10-12-26(13-11-25)20(28)9-8-19(27)24-17-3-1-2-15(14-17)21(23)29/h1-9,14H,10-13H2,(H2,23,29)(H,24,27)/b9-8-
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n/an/a 160n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PARP14 catalytic/WWE domain (1459 to 1801 residues) expressed in Escherichia coli BL21(DE3) preincubated ...


Bioorg Med Chem Lett 27: 2907-2911 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.089
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50242653
PNG
(CHEMBL4074448)
Show SMILES NC(=O)c1cccc(NC(=O)\C=C/C(=O)N2CCC(CC2)c2ccc(F)cc2)c1
Show InChI InChI=1S/C22H22FN3O3/c23-18-6-4-15(5-7-18)16-10-12-26(13-11-16)21(28)9-8-20(27)25-19-3-1-2-17(14-19)22(24)29/h1-9,14,16H,10-13H2,(H2,24,29)(H,25,27)/b9-8-
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n/an/a 270n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PARP14 catalytic/WWE domain (1459 to 1801 residues) expressed in Escherichia coli BL21(DE3) preincubated ...


Bioorg Med Chem Lett 27: 2907-2911 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.089
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50242653
PNG
(CHEMBL4074448)
Show SMILES NC(=O)c1cccc(NC(=O)\C=C/C(=O)N2CCC(CC2)c2ccc(F)cc2)c1
Show InChI InChI=1S/C22H22FN3O3/c23-18-6-4-15(5-7-18)16-10-12-26(13-11-16)21(28)9-8-20(27)25-19-3-1-2-17(14-19)22(24)29/h1-9,14,16H,10-13H2,(H2,24,29)(H,25,27)/b9-8-
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n/an/a 275n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PARP14 catalytic/WWE domain (1459 to 1801 residues) expressed in Escherichia coli BL21(DE3) preincubated ...


Bioorg Med Chem Lett 27: 2907-2911 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.089
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50242657
PNG
(CHEMBL4104938)
Show SMILES CC(C)(C)OC(=O)N1CCN(CC1)C(=O)\C=C/C(=O)Nc1cccc(c1)C(N)=O
Show InChI InChI=1S/C20H26N4O5/c1-20(2,3)29-19(28)24-11-9-23(10-12-24)17(26)8-7-16(25)22-15-6-4-5-14(13-15)18(21)27/h4-8,13H,9-12H2,1-3H3,(H2,21,27)(H,22,25)/b8-7-
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n/an/a 370n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PARP14 catalytic/WWE domain (1459 to 1801 residues) expressed in Escherichia coli BL21(DE3) preincubated ...


Bioorg Med Chem Lett 27: 2907-2911 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.089
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50242657
PNG
(CHEMBL4104938)
Show SMILES CC(C)(C)OC(=O)N1CCN(CC1)C(=O)\C=C/C(=O)Nc1cccc(c1)C(N)=O
Show InChI InChI=1S/C20H26N4O5/c1-20(2,3)29-19(28)24-11-9-23(10-12-24)17(26)8-7-16(25)22-15-6-4-5-14(13-15)18(21)27/h4-8,13H,9-12H2,1-3H3,(H2,21,27)(H,22,25)/b8-7-
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n/an/a 372n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PARP14 catalytic/WWE domain (1459 to 1801 residues) expressed in Escherichia coli BL21(DE3) preincubated ...


Bioorg Med Chem Lett 27: 2907-2911 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.089
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50242652
PNG
(CHEMBL4084742)
Show SMILES CCOC(=O)CC1CCN(CC1)C(=O)\C=C/C(=O)Nc1cccc(c1)C(N)=O
Show InChI InChI=1S/C20H25N3O5/c1-2-28-19(26)12-14-8-10-23(11-9-14)18(25)7-6-17(24)22-16-5-3-4-15(13-16)20(21)27/h3-7,13-14H,2,8-12H2,1H3,(H2,21,27)(H,22,24)/b7-6-
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n/an/a 407n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PARP14 catalytic/WWE domain (1459 to 1801 residues) expressed in Escherichia coli BL21(DE3) preincubated ...


Bioorg Med Chem Lett 27: 2907-2911 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.089
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50242661
PNG
(CHEMBL4079213)
Show SMILES NC(=O)c1cccc(NC(=O)\C=C/C(=O)N2CCN(CC2)c2ccccc2F)c1
Show InChI InChI=1S/C21H21FN4O3/c22-17-6-1-2-7-18(17)25-10-12-26(13-11-25)20(28)9-8-19(27)24-16-5-3-4-15(14-16)21(23)29/h1-9,14H,10-13H2,(H2,23,29)(H,24,27)/b9-8-
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n/an/a 407n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PARP14 catalytic/WWE domain (1459 to 1801 residues) expressed in Escherichia coli BL21(DE3) preincubated ...


Bioorg Med Chem Lett 27: 2907-2911 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.089
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50242661
PNG
(CHEMBL4079213)
Show SMILES NC(=O)c1cccc(NC(=O)\C=C/C(=O)N2CCN(CC2)c2ccccc2F)c1
Show InChI InChI=1S/C21H21FN4O3/c22-17-6-1-2-7-18(17)25-10-12-26(13-11-25)20(28)9-8-19(27)24-16-5-3-4-15(14-16)21(23)29/h1-9,14H,10-13H2,(H2,23,29)(H,24,27)/b9-8-
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n/an/a 410n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PARP14 catalytic/WWE domain (1459 to 1801 residues) expressed in Escherichia coli BL21(DE3) preincubated ...


Bioorg Med Chem Lett 27: 2907-2911 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.089
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50242654
PNG
(CHEMBL4104503)
Show SMILES NC(=O)c1cccc(NC(=O)\C=C/C(=O)N2CCC(Cc3ccccc3)CC2)c1
Show InChI InChI=1S/C23H25N3O3/c24-23(29)19-7-4-8-20(16-19)25-21(27)9-10-22(28)26-13-11-18(12-14-26)15-17-5-2-1-3-6-17/h1-10,16,18H,11-15H2,(H2,24,29)(H,25,27)/b10-9-
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n/an/a 447n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PARP14 catalytic/WWE domain (1459 to 1801 residues) expressed in Escherichia coli BL21(DE3) preincubated ...


Bioorg Med Chem Lett 27: 2907-2911 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.089
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50242654
PNG
(CHEMBL4104503)
Show SMILES NC(=O)c1cccc(NC(=O)\C=C/C(=O)N2CCC(Cc3ccccc3)CC2)c1
Show InChI InChI=1S/C23H25N3O3/c24-23(29)19-7-4-8-20(16-19)25-21(27)9-10-22(28)26-13-11-18(12-14-26)15-17-5-2-1-3-6-17/h1-10,16,18H,11-15H2,(H2,24,29)(H,25,27)/b10-9-
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n/an/a 450n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PARP14 catalytic/WWE domain (1459 to 1801 residues) expressed in Escherichia coli BL21(DE3) preincubated ...


Bioorg Med Chem Lett 27: 2907-2911 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.089
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50242631
PNG
(CHEMBL4068366)
Show SMILES NC(=O)c1cccc(NC(=O)\C=C/C(=O)N2CCN(CC2)c2ccc(Cl)cc2)c1
Show InChI InChI=1S/C21H21ClN4O3/c22-16-4-6-18(7-5-16)25-10-12-26(13-11-25)20(28)9-8-19(27)24-17-3-1-2-15(14-17)21(23)29/h1-9,14H,10-13H2,(H2,23,29)(H,24,27)/b9-8-
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n/an/a 617n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PARP14 catalytic/WWE domain (1459 to 1801 residues) expressed in Escherichia coli BL21(DE3) preincubated ...


Bioorg Med Chem Lett 27: 2907-2911 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.089
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50242655
PNG
(CHEMBL4080281)
Show SMILES NC(=O)c1cccc(NC(=O)\C=C/C(=O)N2CCC(CCc3ccccc3)CC2)c1
Show InChI InChI=1S/C24H27N3O3/c25-24(30)20-7-4-8-21(17-20)26-22(28)11-12-23(29)27-15-13-19(14-16-27)10-9-18-5-2-1-3-6-18/h1-8,11-12,17,19H,9-10,13-16H2,(H2,25,30)(H,26,28)/b12-11-
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n/an/a 650n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PARP14 catalytic/WWE domain (1459 to 1801 residues) expressed in Escherichia coli BL21(DE3) preincubated ...


Bioorg Med Chem Lett 27: 2907-2911 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.089
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50460988
PNG
(CHEMBL4226482)
Show SMILES O=S(=O)(Cc1cccc(c1)C#N)Nc1ccccc1-c1cccc2c1[nH]c1ccccc21
Show InChI InChI=1S/C26H19N3O2S/c27-16-18-7-5-8-19(15-18)17-32(30,31)29-25-14-4-2-10-21(25)23-12-6-11-22-20-9-1-3-13-24(20)28-26(22)23/h1-15,28-29H,17H2
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n/an/a 660n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Displacement of ARTK(Bio)QTARK(Aoa-RADP)S from His6-tagged PARP14 MD2 (A994 to N1191 residues) (unknown origin) expressed in bacterial expression sys...


Bioorg Med Chem 26: 2965-2972 (2018)

More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50242655
PNG
(CHEMBL4080281)
Show SMILES NC(=O)c1cccc(NC(=O)\C=C/C(=O)N2CCC(CCc3ccccc3)CC2)c1
Show InChI InChI=1S/C24H27N3O3/c25-24(30)20-7-4-8-21(17-20)26-22(28)11-12-23(29)27-15-13-19(14-16-27)10-9-18-5-2-1-3-6-18/h1-8,11-12,17,19H,9-10,13-16H2,(H2,25,30)(H,26,28)/b12-11-
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n/an/a 676n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PARP14 catalytic/WWE domain (1459 to 1801 residues) expressed in Escherichia coli BL21(DE3) preincubated ...


Bioorg Med Chem Lett 27: 2907-2911 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.089
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50242658
PNG
(CHEMBL4085694)
Show SMILES NC(=O)c1cccc(NC(=O)\C=C/C(=O)N2CCCC(C2)c2ccccc2)c1
Show InChI InChI=1/C22H23N3O3/c23-22(28)17-8-4-10-19(14-17)24-20(26)11-12-21(27)25-13-5-9-18(15-25)16-6-2-1-3-7-16/h1-4,6-8,10-12,14,18H,5,9,13,15H2,(H2,23,28)(H,24,26)/b12-11-
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n/an/a 690n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PARP14 catalytic/WWE domain (1459 to 1801 residues) expressed in Escherichia coli BL21(DE3) preincubated ...


Bioorg Med Chem Lett 27: 2907-2911 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.089
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50272968
PNG
(CHEMBL4126260)
Show SMILES NC(=O)c1ccc(Oc2cccc(c2)C(=O)N2CCN(CC2)c2ccc(F)c(F)c2)cc1
Show InChI InChI=1S/C24H21F2N3O3/c25-21-9-6-18(15-22(21)26)28-10-12-29(13-11-28)24(31)17-2-1-3-20(14-17)32-19-7-4-16(5-8-19)23(27)30/h1-9,14-15H,10-13H2,(H2,27,30)
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n/an/a 692n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant His6-tagged human PARP14 WWA/catalytic domain expressed in Escherichia coli BL21(DE3) preincubated for 15 mins ...


Bioorg Med Chem Lett 28: 2050-2054 (2018)

More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50242658
PNG
(CHEMBL4085694)
Show SMILES NC(=O)c1cccc(NC(=O)\C=C/C(=O)N2CCCC(C2)c2ccccc2)c1
Show InChI InChI=1/C22H23N3O3/c23-22(28)17-8-4-10-19(14-17)24-20(26)11-12-21(27)25-13-5-9-18(15-25)16-6-2-1-3-7-16/h1-4,6-8,10-12,14,18H,5,9,13,15H2,(H2,23,28)(H,24,26)/b12-11-
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n/an/a 692n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PARP14 catalytic/WWE domain (1459 to 1801 residues) expressed in Escherichia coli BL21(DE3) preincubated ...


Bioorg Med Chem Lett 27: 2907-2911 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.089
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50242630
PNG
(CHEMBL4089522)
Show SMILES NC(=O)c1cccc(NC(=O)\C=C/C(=O)N2CCN(CC2)c2ccc(F)cc2)c1
Show InChI InChI=1S/C21H21FN4O3/c22-16-4-6-18(7-5-16)25-10-12-26(13-11-25)20(28)9-8-19(27)24-17-3-1-2-15(14-17)21(23)29/h1-9,14H,10-13H2,(H2,23,29)(H,24,27)/b9-8-
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n/an/a 700n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibitory concentration against radioligand [3H](+)-NAN binding to haloperidol-sensitive sigma binding site in whole guinea pig brain


Bioorg Med Chem Lett 27: 2907-2911 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.089
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50242630
PNG
(CHEMBL4089522)
Show SMILES NC(=O)c1cccc(NC(=O)\C=C/C(=O)N2CCN(CC2)c2ccc(F)cc2)c1
Show InChI InChI=1S/C21H21FN4O3/c22-16-4-6-18(7-5-16)25-10-12-26(13-11-25)20(28)9-8-19(27)24-17-3-1-2-15(14-17)21(23)29/h1-9,14H,10-13H2,(H2,23,29)(H,24,27)/b9-8-
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n/an/a 700n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant His6-tagged PARP14 catalytic domain (unknown origin) expressed in Escherichia coli BL21(DE3) by fluorescence ba...


Bioorg Med Chem Lett 28: 2050-2054 (2018)

More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50272968
PNG
(CHEMBL4126260)
Show SMILES NC(=O)c1ccc(Oc2cccc(c2)C(=O)N2CCN(CC2)c2ccc(F)c(F)c2)cc1
Show InChI InChI=1S/C24H21F2N3O3/c25-21-9-6-18(15-22(21)26)28-10-12-29(13-11-28)24(31)17-2-1-3-20(14-17)32-19-7-4-16(5-8-19)23(27)30/h1-9,14-15H,10-13H2,(H2,27,30)
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n/an/a 700n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant His6-tagged human PARP14 WWA/catalytic domain expressed in Escherichia coli BL21(DE3) preincubated for 15 mins ...


Bioorg Med Chem Lett 28: 2050-2054 (2018)

More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50242630
PNG
(CHEMBL4089522)
Show SMILES NC(=O)c1cccc(NC(=O)\C=C/C(=O)N2CCN(CC2)c2ccc(F)cc2)c1
Show InChI InChI=1S/C21H21FN4O3/c22-16-4-6-18(7-5-16)25-10-12-26(13-11-25)20(28)9-8-19(27)24-17-3-1-2-15(14-17)21(23)29/h1-9,14H,10-13H2,(H2,23,29)(H,24,27)/b9-8-
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n/an/a 708n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PARP14 catalytic/WWE domain (1459 to 1801 residues) expressed in Escherichia coli BL21(DE3) preincubated ...


Bioorg Med Chem Lett 27: 2907-2911 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.089
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50461016
PNG
(CHEMBL4226393)
Show SMILES CC(=O)Nc1ccccc1-c1cccc2c3ccccc3[nH]c12
Show InChI InChI=1S/C20H16N2O/c1-13(23)21-18-11-4-2-7-14(18)16-9-6-10-17-15-8-3-5-12-19(15)22-20(16)17/h2-12,22H,1H3,(H,21,23)
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n/an/a 720n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Displacement of ARTK(Bio)QTARK(Aoa-RADP)S from His6-tagged PARP14 MD2 (A994 to N1191 residues) (unknown origin) expressed in bacterial expression sys...


Bioorg Med Chem 26: 2965-2972 (2018)

More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50272955
PNG
(CHEMBL4129001)
Show SMILES NC(=O)c1ccc(Oc2cccc(c2)C(=O)N2CCN(CC2)c2ccc(F)cc2)cc1
Show InChI InChI=1S/C24H22FN3O3/c25-19-6-8-20(9-7-19)27-12-14-28(15-13-27)24(30)18-2-1-3-22(16-18)31-21-10-4-17(5-11-21)23(26)29/h1-11,16H,12-15H2,(H2,26,29)
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n/an/a 776n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant His6-tagged human PARP14 WWA/catalytic domain expressed in Escherichia coli BL21(DE3) preincubated for 15 mins ...


Bioorg Med Chem Lett 28: 2050-2054 (2018)

More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50272955
PNG
(CHEMBL4129001)
Show SMILES NC(=O)c1ccc(Oc2cccc(c2)C(=O)N2CCN(CC2)c2ccc(F)cc2)cc1
Show InChI InChI=1S/C24H22FN3O3/c25-19-6-8-20(9-7-19)27-12-14-28(15-13-27)24(30)18-2-1-3-22(16-18)31-21-10-4-17(5-11-21)23(26)29/h1-11,16H,12-15H2,(H2,26,29)
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n/an/a 780n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant His6-tagged human PARP14 WWA/catalytic domain expressed in Escherichia coli BL21(DE3) preincubated for 15 mins ...


Bioorg Med Chem Lett 28: 2050-2054 (2018)

More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50242660
PNG
(CHEMBL4087082)
Show SMILES NC(=O)c1cccc(NC(=O)\C=C/C(=O)N2CCN(CC2)c2ccccc2)c1
Show InChI InChI=1S/C21H22N4O3/c22-21(28)16-5-4-6-17(15-16)23-19(26)9-10-20(27)25-13-11-24(12-14-25)18-7-2-1-3-8-18/h1-10,15H,11-14H2,(H2,22,28)(H,23,26)/b10-9-
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n/an/a 891n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PARP14 catalytic/WWE domain (1459 to 1801 residues) expressed in Escherichia coli BL21(DE3) preincubated ...


Bioorg Med Chem Lett 27: 2907-2911 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.089
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50461015
PNG
(CHEMBL4228040)
Show SMILES CS(=O)(=O)Nc1ccccc1-c1cccc2c1[nH]c1ccccc21
Show InChI InChI=1S/C19H16N2O2S/c1-24(22,23)21-18-12-5-3-8-14(18)16-10-6-9-15-13-7-2-4-11-17(13)20-19(15)16/h2-12,20-21H,1H3
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n/an/a 900n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Displacement of ARTK(Bio)QTARK(Aoa-RADP)S from His6-tagged PARP14 MD2 (A994 to N1191 residues) (unknown origin) expressed in bacterial expression sys...


Bioorg Med Chem 26: 2965-2972 (2018)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50460999
PNG
(CHEMBL4226081)
Show SMILES CCCC(=O)Nc1ccccc1-c1cccc2c1[nH]c1ccccc21
Show InChI InChI=1S/C22H20N2O/c1-2-8-21(25)23-19-13-5-3-9-15(19)17-11-7-12-18-16-10-4-6-14-20(16)24-22(17)18/h3-7,9-14,24H,2,8H2,1H3,(H,23,25)
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n/an/a 900n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Displacement of ARTK(Bio)QTARK(Aoa-RADP)S from His6-tagged PARP14 MD2 (A994 to N1191 residues) (unknown origin) expressed in bacterial expression sys...


Bioorg Med Chem 26: 2965-2972 (2018)

More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50242660
PNG
(CHEMBL4087082)
Show SMILES NC(=O)c1cccc(NC(=O)\C=C/C(=O)N2CCN(CC2)c2ccccc2)c1
Show InChI InChI=1S/C21H22N4O3/c22-21(28)16-5-4-6-17(15-16)23-19(26)9-10-20(27)25-13-11-24(12-14-25)18-7-2-1-3-8-18/h1-10,15H,11-14H2,(H2,22,28)(H,23,26)/b10-9-
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n/an/a 900n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibitory concentration against radioligand [3H](+)-NAN binding to haloperidol-sensitive sigma binding site in whole guinea pig brain


Bioorg Med Chem Lett 27: 2907-2911 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.089
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50461017
PNG
(CHEMBL4229283)
Show SMILES Cc1ccc(CC(=O)Nc2ccccc2-c2cccc3c4ccccc4[nH]c23)cn1
Show InChI InChI=1S/C26H21N3O/c1-17-13-14-18(16-27-17)15-25(30)28-23-11-4-2-7-19(23)21-9-6-10-22-20-8-3-5-12-24(20)29-26(21)22/h2-14,16,29H,15H2,1H3,(H,28,30)
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n/an/a 1.00E+3n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Displacement of ARTK(Bio)QTARK(Aoa-RADP)S from His6-tagged PARP14 MD2 (A994 to N1191 residues) (unknown origin) expressed in bacterial expression sys...


Bioorg Med Chem 26: 2965-2972 (2018)

More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50461040
PNG
(CHEMBL4227680)
Show SMILES CCC(=O)Nc1ccccc1-c1cccc2c1[nH]c1ccccc21
Show InChI InChI=1S/C21H18N2O/c1-2-20(24)22-18-12-5-3-8-14(18)16-10-7-11-17-15-9-4-6-13-19(15)23-21(16)17/h3-13,23H,2H2,1H3,(H,22,24)
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n/an/a 1.00E+3n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Displacement of ARTK(Bio)QTARK(Aoa-RADP)S from His6-tagged PARP14 MD2 (A994 to N1191 residues) (unknown origin) expressed in bacterial expression sys...


Bioorg Med Chem 26: 2965-2972 (2018)

More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50242633
PNG
(CHEMBL4103623)
Show SMILES NC(=O)c1cccc(NC(=O)\C=C/C(=O)N2CCCC(C2)Oc2ccccc2)c1
Show InChI InChI=1/C22H23N3O4/c23-22(28)16-6-4-7-17(14-16)24-20(26)11-12-21(27)25-13-5-10-19(15-25)29-18-8-2-1-3-9-18/h1-4,6-9,11-12,14,19H,5,10,13,15H2,(H2,23,28)(H,24,26)/b12-11-
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n/an/a 1.02E+3n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PARP14 catalytic/WWE domain (1459 to 1801 residues) expressed in Escherichia coli BL21(DE3) preincubated ...


Bioorg Med Chem Lett 27: 2907-2911 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.089
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50272958
PNG
(CHEMBL4126241)
Show SMILES NC(=O)c1ccc(Oc2cccc(c2)C(=O)N2CCN(CC2)c2ccccc2)cc1
Show InChI InChI=1S/C24H23N3O3/c25-23(28)18-9-11-21(12-10-18)30-22-8-4-5-19(17-22)24(29)27-15-13-26(14-16-27)20-6-2-1-3-7-20/h1-12,17H,13-16H2,(H2,25,28)
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n/an/a 1.05E+3n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant His6-tagged human PARP14 WWA/catalytic domain expressed in Escherichia coli BL21(DE3) preincubated for 15 mins ...


Bioorg Med Chem Lett 28: 2050-2054 (2018)

More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50242665
PNG
(CHEMBL4101019)
Show SMILES NC(=O)c1cccc(NC(=O)\C=C/C(=O)N2CCCCC2c2ccccc2)c1
Show InChI InChI=1/C22H23N3O3/c23-22(28)17-9-6-10-18(15-17)24-20(26)12-13-21(27)25-14-5-4-11-19(25)16-7-2-1-3-8-16/h1-3,6-10,12-13,15,19H,4-5,11,14H2,(H2,23,28)(H,24,26)/b13-12-
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n/an/a 1.07E+3n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PARP14 catalytic/WWE domain (1459 to 1801 residues) expressed in Escherichia coli BL21(DE3) preincubated ...


Bioorg Med Chem Lett 27: 2907-2911 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.089
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50272957
PNG
(CHEMBL4127497)
Show SMILES NC(=O)c1ccc(Oc2cccc(c2)C(=O)N2CCN(CC2)c2ccccc2F)cc1
Show InChI InChI=1S/C24H22FN3O3/c25-21-6-1-2-7-22(21)27-12-14-28(15-13-27)24(30)18-4-3-5-20(16-18)31-19-10-8-17(9-11-19)23(26)29/h1-11,16H,12-15H2,(H2,26,29)
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n/an/a 1.07E+3n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant His6-tagged human PARP14 WWA/catalytic domain expressed in Escherichia coli BL21(DE3) preincubated for 15 mins ...


Bioorg Med Chem Lett 28: 2050-2054 (2018)

More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50461007
PNG
(CHEMBL4227641)
Show SMILES CC(=O)Nc1ccccc1-c1cccc2c3CCCCc3[nH]c12
Show InChI InChI=1S/C20H20N2O/c1-13(23)21-18-11-4-2-7-14(18)16-9-6-10-17-15-8-3-5-12-19(15)22-20(16)17/h2,4,6-7,9-11,22H,3,5,8,12H2,1H3,(H,21,23)
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n/an/a 1.10E+3n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Displacement of ARTK(Bio)QTARK(Aoa-RADP)S from His6-tagged PARP14 MD2 (A994 to N1191 residues) (unknown origin) expressed in bacterial expression sys...


Bioorg Med Chem 26: 2965-2972 (2018)

More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50242665
PNG
(CHEMBL4101019)
Show SMILES NC(=O)c1cccc(NC(=O)\C=C/C(=O)N2CCCCC2c2ccccc2)c1
Show InChI InChI=1/C22H23N3O3/c23-22(28)17-9-6-10-18(15-17)24-20(26)12-13-21(27)25-14-5-4-11-19(25)16-7-2-1-3-8-16/h1-3,6-10,12-13,15,19H,4-5,11,14H2,(H2,23,28)(H,24,26)/b13-12-
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n/an/a 1.10E+3n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PARP14 catalytic/WWE domain (1459 to 1801 residues) expressed in Escherichia coli BL21(DE3) preincubated ...


Bioorg Med Chem Lett 27: 2907-2911 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.089
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50461031
PNG
(CHEMBL4228190)
Show SMILES O=C(Cc1cccnc1)Nc1ccccc1-c1cccc2c3ccccc3[nH]c12
Show InChI InChI=1S/C25H19N3O/c29-24(15-17-7-6-14-26-16-17)27-22-12-3-1-8-18(22)20-10-5-11-21-19-9-2-4-13-23(19)28-25(20)21/h1-14,16,28H,15H2,(H,27,29)
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University of Oxford

Curated by ChEMBL


Assay Description
Displacement of ARTK(Bio)QTARK(Aoa-RADP)S from His6-tagged PARP14 MD2 (A994 to N1191 residues) (unknown origin) expressed in bacterial expression sys...


Bioorg Med Chem 26: 2965-2972 (2018)

More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50461042
PNG
(CHEMBL4228635)
Show SMILES Cc1ccc(c(NS(C)(=O)=O)c1)-c1cccc2c1[nH]c1ccccc21
Show InChI InChI=1S/C20H18N2O2S/c1-13-10-11-15(19(12-13)22-25(2,23)24)17-8-5-7-16-14-6-3-4-9-18(14)21-20(16)17/h3-12,21-22H,1-2H3
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n/an/a 1.10E+3n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Displacement of ARTK(Bio)QTARK(Aoa-RADP)S from His6-tagged PARP14 MD2 (A994 to N1191 residues) (unknown origin) expressed in bacterial expression sys...


Bioorg Med Chem 26: 2965-2972 (2018)

More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50460993
PNG
(CHEMBL4227157)
Show SMILES FC(F)(F)C(=O)Nc1ccccc1-c1cccc2c3ccccc3[nH]c12
Show InChI InChI=1S/C20H13F3N2O/c21-20(22,23)19(26)25-17-11-4-2-7-13(17)15-9-5-8-14-12-6-1-3-10-16(12)24-18(14)15/h1-11,24H,(H,25,26)
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n/an/a 1.10E+3n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Displacement of ARTK(Bio)QTARK(Aoa-RADP)S from His6-tagged PARP14 MD2 (A994 to N1191 residues) (unknown origin) expressed in bacterial expression sys...


Bioorg Med Chem 26: 2965-2972 (2018)

More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50461036
PNG
(CHEMBL4225366)
Show SMILES Fc1ccc(cc1CS(=O)(=O)Nc1ccccc1-c1cccc2c1[nH]c1ccccc21)C#N
Show InChI InChI=1S/C26H18FN3O2S/c27-23-13-12-17(15-28)14-18(23)16-33(31,32)30-25-11-4-2-7-20(25)22-9-5-8-21-19-6-1-3-10-24(19)29-26(21)22/h1-14,29-30H,16H2
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n/an/a 1.20E+3n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Displacement of ARTK(Bio)QTARK(Aoa-RADP)S from His6-tagged PARP14 MD2 (A994 to N1191 residues) (unknown origin) expressed in bacterial expression sys...


Bioorg Med Chem 26: 2965-2972 (2018)

More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50460995
PNG
(CHEMBL4227601)
Show SMILES O=C(Nc1ccccc1-c1cccc2c1[nH]c1ccccc21)C1CC1
Show InChI InChI=1S/C22H18N2O/c25-22(14-12-13-14)24-20-11-4-2-7-16(20)18-9-5-8-17-15-6-1-3-10-19(15)23-21(17)18/h1-11,14,23H,12-13H2,(H,24,25)
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n/an/a 1.20E+3n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Displacement of ARTK(Bio)QTARK(Aoa-RADP)S from His6-tagged PARP14 MD2 (A994 to N1191 residues) (unknown origin) expressed in bacterial expression sys...


Bioorg Med Chem 26: 2965-2972 (2018)

More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50460985
PNG
(CHEMBL4227446)
Show SMILES CCS(=O)(=O)Nc1ccccc1-c1cccc2c1[nH]c1ccccc21
Show InChI InChI=1S/C20H18N2O2S/c1-2-25(23,24)22-19-13-6-4-9-15(19)17-11-7-10-16-14-8-3-5-12-18(14)21-20(16)17/h3-13,21-22H,2H2,1H3
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n/an/a 1.20E+3n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Displacement of ARTK(Bio)QTARK(Aoa-RADP)S from His6-tagged PARP14 MD2 (A994 to N1191 residues) (unknown origin) expressed in bacterial expression sys...


Bioorg Med Chem 26: 2965-2972 (2018)

More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50272959
PNG
(CHEMBL4125748)
Show SMILES NC(=O)c1ccc(Oc2cccc(c2)C(=O)N2CCC(O)(CC2)c2ccc(F)cc2)cc1
Show InChI InChI=1S/C25H23FN2O4/c26-20-8-6-19(7-9-20)25(31)12-14-28(15-13-25)24(30)18-2-1-3-22(16-18)32-21-10-4-17(5-11-21)23(27)29/h1-11,16,31H,12-15H2,(H2,27,29)
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n/an/a 1.29E+3n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant His6-tagged human PARP14 WWA/catalytic domain expressed in Escherichia coli BL21(DE3) preincubated for 15 mins ...


Bioorg Med Chem Lett 28: 2050-2054 (2018)

More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50272959
PNG
(CHEMBL4125748)
Show SMILES NC(=O)c1ccc(Oc2cccc(c2)C(=O)N2CCC(O)(CC2)c2ccc(F)cc2)cc1
Show InChI InChI=1S/C25H23FN2O4/c26-20-8-6-19(7-9-20)25(31)12-14-28(15-13-25)24(30)18-2-1-3-22(16-18)32-21-10-4-17(5-11-21)23(27)29/h1-11,16,31H,12-15H2,(H2,27,29)
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n/an/a 1.30E+3n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant His6-tagged human PARP14 WWA/catalytic domain expressed in Escherichia coli BL21(DE3) preincubated for 15 mins ...


Bioorg Med Chem Lett 28: 2050-2054 (2018)

More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50272958
PNG
(CHEMBL4126241)
Show SMILES NC(=O)c1ccc(Oc2cccc(c2)C(=O)N2CCN(CC2)c2ccccc2)cc1
Show InChI InChI=1S/C24H23N3O3/c25-23(28)18-9-11-21(12-10-18)30-22-8-4-5-19(17-22)24(29)27-15-13-26(14-16-27)20-6-2-1-3-7-20/h1-12,17H,13-16H2,(H2,25,28)
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n/an/a 1.30E+3n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant His6-tagged human PARP14 WWA/catalytic domain expressed in Escherichia coli BL21(DE3) preincubated for 15 mins ...


Bioorg Med Chem Lett 28: 2050-2054 (2018)

More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50242633
PNG
(CHEMBL4103623)
Show SMILES NC(=O)c1cccc(NC(=O)\C=C/C(=O)N2CCCC(C2)Oc2ccccc2)c1
Show InChI InChI=1/C22H23N3O4/c23-22(28)16-6-4-7-17(14-16)24-20(26)11-12-21(27)25-13-5-10-19(15-25)29-18-8-2-1-3-9-18/h1-4,6-9,11-12,14,19H,5,10,13,15H2,(H2,23,28)(H,24,26)/b12-11-
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n/an/a 1.40E+3n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PARP14 catalytic/WWE domain (1459 to 1801 residues) expressed in Escherichia coli BL21(DE3) preincubated ...


Bioorg Med Chem Lett 27: 2907-2911 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.089
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50460991
PNG
(CHEMBL4227317)
Show SMILES CC(=O)Nc1ccccc1-c1cccc2c1[nH]c1c(Cl)c(Cl)ccc21
Show InChI InChI=1S/C20H14Cl2N2O/c1-11(25)23-17-8-3-2-5-12(17)13-6-4-7-14-15-9-10-16(21)18(22)20(15)24-19(13)14/h2-10,24H,1H3,(H,23,25)
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n/an/a 1.40E+3n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Displacement of ARTK(Bio)QTARK(Aoa-RADP)S from His6-tagged PARP14 MD2 (A994 to N1191 residues) (unknown origin) expressed in bacterial expression sys...


Bioorg Med Chem 26: 2965-2972 (2018)

More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50461019
PNG
(CHEMBL4225117)
Show SMILES Fc1cccc(CS(=O)(=O)Nc2ccccc2-c2cccc3c2[nH]c2ccccc32)c1
Show InChI InChI=1S/C25H19FN2O2S/c26-18-8-5-7-17(15-18)16-31(29,30)28-24-14-4-2-10-20(24)22-12-6-11-21-19-9-1-3-13-23(19)27-25(21)22/h1-15,27-28H,16H2
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n/an/a 1.40E+3n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Displacement of ARTK(Bio)QTARK(Aoa-RADP)S from His6-tagged PARP14 MD2 (A994 to N1191 residues) (unknown origin) expressed in bacterial expression sys...


Bioorg Med Chem 26: 2965-2972 (2018)

More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 14


(Homo sapiens (Human))
BDBM50272953
PNG
(CHEMBL4128574)
Show SMILES NC(=O)c1ccc(Oc2cccc(c2)C(=O)N2CCC(CC2)c2cccc(F)c2)cc1
Show InChI InChI=1S/C25H23FN2O3/c26-21-5-1-3-19(15-21)17-11-13-28(14-12-17)25(30)20-4-2-6-23(16-20)31-22-9-7-18(8-10-22)24(27)29/h1-10,15-17H,11-14H2,(H2,27,29)
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n/an/a 1.45E+3n/an/an/an/an/an/a



McDaniel College

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant His6-tagged human PARP14 WWA/catalytic domain expressed in Escherichia coli BL21(DE3) preincubated for 15 mins ...


Bioorg Med Chem Lett 28: 2050-2054 (2018)

More data for this
Ligand-Target Pair
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