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PubMed code 16078828

Compile data set for download or QSAR
Found 25 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
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))		BDBM27525
PNG
(N-[3-(morpholin-4-yl)propyl]-8-oxo-9-azatetracyclo...)
Show SMILES O=c1[nH]c-2c(Cc3cc(ccc-23)S(=O)(=O)NCCCN2CCOCC2)c2ccccc12
Show InChI InChI=1S/C23H25N3O4S/c27-23-20-5-2-1-4-19(20)21-15-16-14-17(6-7-18(16)22(21)25-23)31(28,29)24-8-3-9-26-10-12-30-13-11-26/h1-2,4-7,14,24H,3,8-13,15H2,(H,25,27)
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n/an/a 1n/an/an/an/a8.022



Inotek Pharmaceuticals Corporation



Assay Description
The potency of inhibition on purified PARP enzyme was determined for selected compounds, and the potency was compared with that of 3-aminobenzamide (...

J Med Chem 48: 5100-3 (2005)


Article DOI: 10.1021/jm0502891
BindingDB Entry DOI: 10.7270/Q2GF0RT9
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))		BDBM27528
PNG
(13-fluoro-N-[3-(morpholin-4-yl)propyl]-8-oxo-9-aza...)
Show SMILES Fc1cc-2c(Cc3c-2[nH]c(=O)c2ccccc32)cc1S(=O)(=O)NCCCN1CCOCC1
Show InChI InChI=1S/C23H24FN3O4S/c24-20-14-18-15(12-19-16-4-1-2-5-17(16)23(28)26-22(18)19)13-21(20)32(29,30)25-6-3-7-27-8-10-31-11-9-27/h1-2,4-5,13-14,25H,3,6-12H2,(H,26,28)
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n/an/a 10n/an/an/an/a8.022



Inotek Pharmaceuticals Corporation



Assay Description
The potency of inhibition on purified PARP enzyme was determined for selected compounds, and the potency was compared with that of 3-aminobenzamide (...

J Med Chem 48: 5100-3 (2005)


Article DOI: 10.1021/jm0502891
BindingDB Entry DOI: 10.7270/Q2GF0RT9
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))		BDBM27521
PNG
(2-[4-(4-fluorophenyl)piperazin-1-yl]-N-{8-oxo-9-az...)
Show SMILES Fc1ccc(cc1)N1CCN(CC(=O)Nc2ccc-3c(Cc4c-3[nH]c(=O)c3ccccc43)c2)CC1
Show InChI InChI=1S/C28H25FN4O2/c29-19-5-8-21(9-6-19)33-13-11-32(12-14-33)17-26(34)30-20-7-10-22-18(15-20)16-25-23-3-1-2-4-24(23)28(35)31-27(22)25/h1-10,15H,11-14,16-17H2,(H,30,34)(H,31,35)
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n/an/a 80n/an/an/an/a8.022



Inotek Pharmaceuticals Corporation



Assay Description
The potency of inhibition on purified PARP enzyme was determined for selected compounds, and the potency was compared with that of 3-aminobenzamide (...

J Med Chem 48: 5100-3 (2005)


Article DOI: 10.1021/jm0502891
BindingDB Entry DOI: 10.7270/Q2GF0RT9
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))		BDBM27515
PNG
(14-amino-9-azatetracyclo[8.7.0.0^{2,7}.0^{11,16}]h...)
Show SMILES Nc1ccc-2c(Cc3c-2[nH]c(=O)c2ccccc32)c1
Show InChI InChI=1S/C16H12N2O/c17-10-5-6-11-9(7-10)8-14-12-3-1-2-4-13(12)16(19)18-15(11)14/h1-7H,8,17H2,(H,18,19)
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n/an/a 98n/an/an/an/a8.022



Inotek Pharmaceuticals Corporation



Assay Description
The potency of inhibition on purified PARP enzyme was determined for selected compounds, and the potency was compared with that of 3-aminobenzamide (...

J Med Chem 48: 5100-3 (2005)


Article DOI: 10.1021/jm0502891
BindingDB Entry DOI: 10.7270/Q2GF0RT9
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))		BDBM27524
PNG
(1-{8-oxo-9-azatetracyclo[8.7.0.0^{2,7}.0^{11,16}]h...)
Show SMILES CCCNC(=O)Nc1ccc-2c(Cc3c-2[nH]c(=O)c2ccccc32)c1
Show InChI InChI=1S/C20H19N3O2/c1-2-9-21-20(25)22-13-7-8-14-12(10-13)11-17-15-5-3-4-6-16(15)19(24)23-18(14)17/h3-8,10H,2,9,11H2,1H3,(H,23,24)(H2,21,22,25)
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n/an/a 100n/an/an/an/a8.022



Inotek Pharmaceuticals Corporation



Assay Description
The potency of inhibition on purified PARP enzyme was determined for selected compounds, and the potency was compared with that of 3-aminobenzamide (...

J Med Chem 48: 5100-3 (2005)


Article DOI: 10.1021/jm0502891
BindingDB Entry DOI: 10.7270/Q2GF0RT9
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))		BDBM27522
PNG
(4-(morpholin-4-yl)-N-{8-oxo-9-azatetracyclo[8.7.0....)
Show SMILES O=C(CCCN1CCOCC1)Nc1ccc-2c(Cc3c-2[nH]c(=O)c2ccccc32)c1
Show InChI InChI=1S/C24H25N3O3/c28-22(6-3-9-27-10-12-30-13-11-27)25-17-7-8-18-16(14-17)15-21-19-4-1-2-5-20(19)24(29)26-23(18)21/h1-2,4-5,7-8,14H,3,6,9-13,15H2,(H,25,28)(H,26,29)
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n/an/a 105n/an/an/an/a8.022



Inotek Pharmaceuticals Corporation



Assay Description
The potency of inhibition on purified PARP enzyme was determined for selected compounds, and the potency was compared with that of 3-aminobenzamide (...

J Med Chem 48: 5100-3 (2005)


Article DOI: 10.1021/jm0502891
BindingDB Entry DOI: 10.7270/Q2GF0RT9
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))		BDBM27520
PNG
(2-(dimethylamino)-N-{8-oxo-9-azatetracyclo[8.7.0.0...)
Show SMILES CN(C)CC(=O)Nc1ccc-2c(Cc3c-2[nH]c(=O)c2ccccc32)c1
Show InChI InChI=1S/C20H19N3O2/c1-23(2)11-18(24)21-13-7-8-14-12(9-13)10-17-15-5-3-4-6-16(15)20(25)22-19(14)17/h3-9H,10-11H2,1-2H3,(H,21,24)(H,22,25)
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n/an/a 107n/an/an/an/a8.022



Inotek Pharmaceuticals Corporation



Assay Description
The potency of inhibition on purified PARP enzyme was determined for selected compounds, and the potency was compared with that of 3-aminobenzamide (...

J Med Chem 48: 5100-3 (2005)


Article DOI: 10.1021/jm0502891
BindingDB Entry DOI: 10.7270/Q2GF0RT9
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))		BDBM27523
PNG
(2-hydroxy-N-{8-oxo-9-azatetracyclo[8.7.0.0^{2,7}.0...)
Show SMILES OCC(=O)Nc1ccc-2c(Cc3c-2[nH]c(=O)c2ccccc32)c1
Show InChI InChI=1S/C18H14N2O3/c21-9-16(22)19-11-5-6-12-10(7-11)8-15-13-3-1-2-4-14(13)18(23)20-17(12)15/h1-7,21H,8-9H2,(H,19,22)(H,20,23)
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n/an/a 110n/an/an/an/a8.022



Inotek Pharmaceuticals Corporation



Assay Description
The potency of inhibition on purified PARP enzyme was determined for selected compounds, and the potency was compared with that of 3-aminobenzamide (...

J Med Chem 48: 5100-3 (2005)


Article DOI: 10.1021/jm0502891
BindingDB Entry DOI: 10.7270/Q2GF0RT9
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))		BDBM27514
PNG
(13-amino-9-azatetracyclo[8.7.0.0^{2,7}.0^{11,16}]h...)
Show SMILES Nc1ccc2Cc3c([nH]c(=O)c4ccccc34)-c2c1
Show InChI InChI=1S/C16H12N2O/c17-10-6-5-9-7-14-11-3-1-2-4-12(11)16(19)18-15(14)13(9)8-10/h1-6,8H,7,17H2,(H,18,19)
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n/an/a 300n/an/an/an/a8.022



Inotek Pharmaceuticals Corporation



Assay Description
The potency of inhibition on purified PARP enzyme was determined for selected compounds, and the potency was compared with that of 3-aminobenzamide (...

J Med Chem 48: 5100-3 (2005)


Article DOI: 10.1021/jm0502891
BindingDB Entry DOI: 10.7270/Q2GF0RT9
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))		BDBM27511
PNG
(14-nitro-9-azatetracyclo[8.7.0.0^{2,7}.0^{11,16}]h...)
Show SMILES [O-][N+](=O)c1ccc-2c(Cc3c-2[nH]c(=O)c2ccccc32)c1
Show InChI InChI=1S/C16H10N2O3/c19-16-13-4-2-1-3-12(13)14-8-9-7-10(18(20)21)5-6-11(9)15(14)17-16/h1-7H,8H2,(H,17,19)
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n/an/a 300n/an/an/an/a8.022



Inotek Pharmaceuticals Corporation



Assay Description
The potency of inhibition on purified PARP enzyme was determined for selected compounds, and the potency was compared with that of 3-aminobenzamide (...

J Med Chem 48: 5100-3 (2005)


Article DOI: 10.1021/jm0502891
BindingDB Entry DOI: 10.7270/Q2GF0RT9
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))		BDBM27526
PNG
(N-[3-(1H-imidazol-1-yl)propyl]-8-oxo-9-azatetracyc...)
Show SMILES O=c1[nH]c-2c(Cc3cc(ccc-23)S(=O)(=O)NCCCn2ccnc2)c2ccccc12
Show InChI InChI=1S/C22H20N4O3S/c27-22-19-5-2-1-4-18(19)20-13-15-12-16(6-7-17(15)21(20)25-22)30(28,29)24-8-3-10-26-11-9-23-14-26/h1-2,4-7,9,11-12,14,24H,3,8,10,13H2,(H,25,27)
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n/an/a 394n/an/an/an/a8.022



Inotek Pharmaceuticals Corporation



Assay Description
The potency of inhibition on purified PARP enzyme was determined for selected compounds, and the potency was compared with that of 3-aminobenzamide (...

J Med Chem 48: 5100-3 (2005)


Article DOI: 10.1021/jm0502891
BindingDB Entry DOI: 10.7270/Q2GF0RT9
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))		BDBM27519
PNG
(4-(morpholin-4-yl)-N-{8-oxo-9-azatetracyclo[8.7.0....)
Show SMILES O=C(CCCN1CCOCC1)Nc1ccc2Cc3c([nH]c(=O)c4ccccc34)-c2c1
Show InChI InChI=1S/C24H25N3O3/c28-22(6-3-9-27-10-12-30-13-11-27)25-17-8-7-16-14-21-18-4-1-2-5-19(18)24(29)26-23(21)20(16)15-17/h1-2,4-5,7-8,15H,3,6,9-14H2,(H,25,28)(H,26,29)
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n/an/a 400n/an/an/an/a8.022



Inotek Pharmaceuticals Corporation



Assay Description
The potency of inhibition on purified PARP enzyme was determined for selected compounds, and the potency was compared with that of 3-aminobenzamide (...

J Med Chem 48: 5100-3 (2005)


Article DOI: 10.1021/jm0502891
BindingDB Entry DOI: 10.7270/Q2GF0RT9
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))		BDBM27529
PNG
(13-fluoro-N-(morpholin-4-yl)-8-oxo-9-azatetracyclo...)
Show SMILES Fc1cc-2c(Cc3c-2[nH]c(=O)c2ccccc32)cc1S(=O)(=O)NN1CCOCC1
Show InChI InChI=1S/C20H18FN3O4S/c21-17-11-15-12(10-18(17)29(26,27)23-24-5-7-28-8-6-24)9-16-13-3-1-2-4-14(13)20(25)22-19(15)16/h1-4,10-11,23H,5-9H2,(H,22,25)
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n/an/a 450n/an/an/an/a8.022



Inotek Pharmaceuticals Corporation



Assay Description
The potency of inhibition on purified PARP enzyme was determined for selected compounds, and the potency was compared with that of 3-aminobenzamide (...

J Med Chem 48: 5100-3 (2005)


Article DOI: 10.1021/jm0502891
BindingDB Entry DOI: 10.7270/Q2GF0RT9
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))		BDBM27530
PNG
(13-fluoro-14-(1H-imidazole-1-sulfonyl)-9-azatetrac...)
Show SMILES Fc1cc-2c(Cc3c-2[nH]c(=O)c2ccccc32)cc1S(=O)(=O)n1ccnc1
Show InChI InChI=1S/C19H12FN3O3S/c20-16-9-14-11(8-17(16)27(25,26)23-6-5-21-10-23)7-15-12-3-1-2-4-13(12)19(24)22-18(14)15/h1-6,8-10H,7H2,(H,22,24)
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n/an/a 500n/an/an/an/a8.022



Inotek Pharmaceuticals Corporation



Assay Description
The potency of inhibition on purified PARP enzyme was determined for selected compounds, and the potency was compared with that of 3-aminobenzamide (...

J Med Chem 48: 5100-3 (2005)


Article DOI: 10.1021/jm0502891
BindingDB Entry DOI: 10.7270/Q2GF0RT9
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))		BDBM27510
PNG
(13-nitro-9-azatetracyclo[8.7.0.0^{2,7}.0^{11,16}]h...)
Show SMILES [O-][N+](=O)c1ccc2Cc3c([nH]c(=O)c4ccccc34)-c2c1
Show InChI InChI=1S/C16H10N2O3/c19-16-12-4-2-1-3-11(12)14-7-9-5-6-10(18(20)21)8-13(9)15(14)17-16/h1-6,8H,7H2,(H,17,19)
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n/an/a 500n/an/an/an/a8.022



Inotek Pharmaceuticals Corporation



Assay Description
The potency of inhibition on purified PARP enzyme was determined for selected compounds, and the potency was compared with that of 3-aminobenzamide (...

J Med Chem 48: 5100-3 (2005)


Article DOI: 10.1021/jm0502891
BindingDB Entry DOI: 10.7270/Q2GF0RT9
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))		BDBM27512
PNG
(13-fluoro-9-azatetracyclo[8.7.0.0^{2,7}.0^{11,16}]...)
Show SMILES Fc1ccc2Cc3c([nH]c(=O)c4ccccc34)-c2c1
Show InChI InChI=1S/C16H10FNO/c17-10-6-5-9-7-14-11-3-1-2-4-12(11)16(19)18-15(14)13(9)8-10/h1-6,8H,7H2,(H,18,19)
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Inotek Pharmaceuticals Corporation



Assay Description
The potency of inhibition on purified PARP enzyme was determined for selected compounds, and the potency was compared with that of 3-aminobenzamide (...

J Med Chem 48: 5100-3 (2005)


Article DOI: 10.1021/jm0502891
BindingDB Entry DOI: 10.7270/Q2GF0RT9
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))		BDBM27513
PNG
(14-fluoro-9-azatetracyclo[8.7.0.0^{2,7}.0^{11,16}]...)
Show SMILES Fc1ccc-2c(Cc3c-2[nH]c(=O)c2ccccc32)c1
Show InChI InChI=1S/C16H10FNO/c17-10-5-6-11-9(7-10)8-14-12-3-1-2-4-13(12)16(19)18-15(11)14/h1-7H,8H2,(H,18,19)
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n/an/a 650n/an/an/an/a8.022



Inotek Pharmaceuticals Corporation



Assay Description
The potency of inhibition on purified PARP enzyme was determined for selected compounds, and the potency was compared with that of 3-aminobenzamide (...

J Med Chem 48: 5100-3 (2005)


Article DOI: 10.1021/jm0502891
BindingDB Entry DOI: 10.7270/Q2GF0RT9
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))		BDBM27531
PNG
(indeno[1,2-c]isoquinolinone, 13 | sodium 8-oxo-9-a...)
Show SMILES [O-]S(=O)(=O)c1ccc-2c(Cc3c-2[nH]c(=O)c2ccccc32)c1
Show InChI InChI=1S/C16H11NO4S/c18-16-13-4-2-1-3-12(13)14-8-9-7-10(22(19,20)21)5-6-11(9)15(14)17-16/h1-7H,8H2,(H,17,18)(H,19,20,21)/p-1
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n/an/a 700n/an/an/an/a8.022



Inotek Pharmaceuticals Corporation



Assay Description
The potency of inhibition on purified PARP enzyme was determined for selected compounds, and the potency was compared with that of 3-aminobenzamide (...

J Med Chem 48: 5100-3 (2005)


Article DOI: 10.1021/jm0502891
BindingDB Entry DOI: 10.7270/Q2GF0RT9
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))		BDBM27516
PNG
(2-(dimethylamino)-N-{8-oxo-9-azatetracyclo[8.7.0.0...)
Show SMILES CN(C)CC(=O)Nc1ccc2Cc3c([nH]c(=O)c4ccccc34)-c2c1
Show InChI InChI=1S/C20H19N3O2/c1-23(2)11-18(24)21-13-8-7-12-9-17-14-5-3-4-6-15(14)20(25)22-19(17)16(12)10-13/h3-8,10H,9,11H2,1-2H3,(H,21,24)(H,22,25)
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n/an/a 800n/an/an/an/a8.022



Inotek Pharmaceuticals Corporation



Assay Description
The potency of inhibition on purified PARP enzyme was determined for selected compounds, and the potency was compared with that of 3-aminobenzamide (...

J Med Chem 48: 5100-3 (2005)


Article DOI: 10.1021/jm0502891
BindingDB Entry DOI: 10.7270/Q2GF0RT9
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))		BDBM27532
PNG
(4-methyl-4-[3-({8-oxo-9-azatetracyclo[8.7.0.0^{2,7...)
Show SMILES C[N+]1(CCCNS(=O)(=O)c2ccc-3c(Cc4c-3[nH]c(=O)c3ccccc43)c2)CCOCC1
Show InChI InChI=1S/C24H27N3O4S/c1-27(11-13-31-14-12-27)10-4-9-25-32(29,30)18-7-8-19-17(15-18)16-22-20-5-2-3-6-21(20)24(28)26-23(19)22/h2-3,5-8,15,25H,4,9-14,16H2,1H3/p+1
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n/an/a 800n/an/an/an/a8.022



Inotek Pharmaceuticals Corporation



Assay Description
The potency of inhibition on purified PARP enzyme was determined for selected compounds, and the potency was compared with that of 3-aminobenzamide (...

J Med Chem 48: 5100-3 (2005)


Article DOI: 10.1021/jm0502891
BindingDB Entry DOI: 10.7270/Q2GF0RT9
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))		BDBM27517
PNG
(2-(morpholin-4-yl)-N-{8-oxo-9-azatetracyclo[8.7.0....)
Show SMILES O=C(CN1CCOCC1)Nc1ccc2Cc3c([nH]c(=O)c4ccccc34)-c2c1
Show InChI InChI=1S/C22H21N3O3/c26-20(13-25-7-9-28-10-8-25)23-15-6-5-14-11-19-16-3-1-2-4-17(16)22(27)24-21(19)18(14)12-15/h1-6,12H,7-11,13H2,(H,23,26)(H,24,27)
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n/an/a>3.00E+3n/an/an/an/a8.022



Inotek Pharmaceuticals Corporation



Assay Description
The potency of inhibition on purified PARP enzyme was determined for selected compounds, and the potency was compared with that of 3-aminobenzamide (...

J Med Chem 48: 5100-3 (2005)


Article DOI: 10.1021/jm0502891
BindingDB Entry DOI: 10.7270/Q2GF0RT9
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))		BDBM27518
PNG
(2-(4-methylpiperazin-1-yl)-N-{8-oxo-9-azatetracycl...)
Show SMILES CN1CCN(CC(=O)Nc2ccc3Cc4c([nH]c(=O)c5ccccc45)-c3c2)CC1
Show InChI InChI=1S/C23H24N4O2/c1-26-8-10-27(11-9-26)14-21(28)24-16-7-6-15-12-20-17-4-2-3-5-18(17)23(29)25-22(20)19(15)13-16/h2-7,13H,8-12,14H2,1H3,(H,24,28)(H,25,29)
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n/an/a>3.00E+3n/an/an/an/a8.022



Inotek Pharmaceuticals Corporation



Assay Description
The potency of inhibition on purified PARP enzyme was determined for selected compounds, and the potency was compared with that of 3-aminobenzamide (...

J Med Chem 48: 5100-3 (2005)


Article DOI: 10.1021/jm0502891
BindingDB Entry DOI: 10.7270/Q2GF0RT9
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))		BDBM27527
PNG
(8-oxo-N-(3-phenylpropyl)-9-azatetracyclo[8.7.0.0^{...)
Show SMILES O=c1[nH]c-2c(Cc3cc(ccc-23)S(=O)(=O)NCCCc2ccccc2)c2ccccc12
Show InChI InChI=1S/C25H22N2O3S/c28-25-22-11-5-4-10-21(22)23-16-18-15-19(12-13-20(18)24(23)27-25)31(29,30)26-14-6-9-17-7-2-1-3-8-17/h1-5,7-8,10-13,15,26H,6,9,14,16H2,(H,27,28)
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n/an/a>3.00E+3n/an/an/an/a8.022



Inotek Pharmaceuticals Corporation



Assay Description
The potency of inhibition on purified PARP enzyme was determined for selected compounds, and the potency was compared with that of 3-aminobenzamide (...

J Med Chem 48: 5100-3 (2005)


Article DOI: 10.1021/jm0502891
BindingDB Entry DOI: 10.7270/Q2GF0RT9
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))		BDBM27508
PNG
(9-azatetracyclo[8.7.0.0^{2,7}.0^{11,16}]heptadeca-...)
Show SMILES O=c1[nH]c-2c(Cc3ccccc-23)c2ccccc12
Show InChI InChI=1S/C16H11NO/c18-16-13-8-4-3-7-12(13)14-9-10-5-1-2-6-11(10)15(14)17-16/h1-8H,9H2,(H,17,18)
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n/an/a>3.00E+3n/an/an/an/a8.022



Inotek Pharmaceuticals Corporation



Assay Description
The potency of inhibition on purified PARP enzyme was determined for selected compounds, and the potency was compared with that of 3-aminobenzamide (...

J Med Chem 48: 5100-3 (2005)


Article DOI: 10.1021/jm0502891
BindingDB Entry DOI: 10.7270/Q2GF0RT9
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))		BDBM27506
PNG
(3-AB | 3-aminobenzamide | CHEMBL81977)
Show SMILES NC(=O)c1cccc(N)c1
Show InChI InChI=1S/C7H8N2O/c8-6-3-1-2-5(4-6)7(9)10/h1-4H,8H2,(H2,9,10)
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n/an/a 3.00E+4n/an/an/an/a8.022



Inotek Pharmaceuticals Corporation



Assay Description
The potency of inhibition on purified PARP enzyme was determined for selected compounds, and the potency was compared with that of 3-aminobenzamide (...

J Med Chem 48: 5100-3 (2005)


Article DOI: 10.1021/jm0502891
BindingDB Entry DOI: 10.7270/Q2GF0RT9
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%