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50 similar compounds to monomer 27135

Compile data set for download or QSAR
Wt: 244.2
BDBM27136
Purchase
Wt: 258.3
BDBM27137
Wt: 216.2
BDBM27092
Wt: 230.2
BDBM27094
Wt: 244.2
BDBM27138
Wt: 300.3
BDBM27143
Wt: 286.3
BDBM27144
Wt: 230.2
BDBM27095
Wt: 244.2
BDBM27097
Wt: 258.3
BDBM27141
Wt: 244.2
BDBM27142
Wt: 286.3
BDBM27150
Wt: 298.3
BDBM27151
Wt: 244.2
BDBM27098
Wt: 230.2
BDBM27146
Displayed 1 to 15 (of 50 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 17 hits for monomerid = 27136,27137,27092,27094,27138,27143,27144,27095,27097,27141,27142,27150,27151,27098,27146   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))
BDBM27141
PNG
(2-(2-methylpiperidin-2-yl)-1H-1,3-benzodiazole-4-c...)
Show SMILES CC1(CCCCN1)c1nc2cccc(C(N)=O)c2[nH]1
Show InChI InChI=1S/C14H18N4O/c1-14(7-2-3-8-16-14)13-17-10-6-4-5-9(12(15)19)11(10)18-13/h4-6,16H,2-3,7-8H2,1H3,(H2,15,19)(H,17,18)
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5 -11.2n/an/an/an/an/a8.022



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Assay Description
PARP assays utilizing SPA bead-based detection were carried out in 96-well plates. After reaction was terminated, the reaction mixtures were transfer...


J Med Chem 52: 514-23 (2009)


Article DOI: 10.1021/jm801171j
BindingDB Entry DOI: 10.7270/Q2DN43CK
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))
BDBM27136
PNG
(2-[(2S)-2-methylpyrrolidin-2-yl]-1H-1,3-benzodiazo...)
Show SMILES C[C@]1(CCCN1)c1nc2cccc(C(N)=O)c2[nH]1
Show InChI InChI=1S/C13H16N4O/c1-13(6-3-7-15-13)12-16-9-5-2-4-8(11(14)18)10(9)17-12/h2,4-5,15H,3,6-7H2,1H3,(H2,14,18)(H,16,17)/t13-/m0/s1
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5 -11.2n/an/an/an/an/a8.022



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Assay Description
PARP assays utilizing SPA bead-based detection were carried out in 96-well plates. After reaction was terminated, the reaction mixtures were transfer...


J Med Chem 52: 514-23 (2009)


Article DOI: 10.1021/jm801171j
BindingDB Entry DOI: 10.7270/Q2DN43CK
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))
BDBM27137
PNG
(2-(1,2-dimethylpyrrolidin-2-yl)-1H-1,3-benzodiazol...)
Show SMILES CN1CCCC1(C)c1nc2cccc(C(N)=O)c2[nH]1
Show InChI InChI=1S/C14H18N4O/c1-14(7-4-8-18(14)2)13-16-10-6-3-5-9(12(15)19)11(10)17-13/h3,5-6H,4,7-8H2,1-2H3,(H2,15,19)(H,16,17)
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6 -11.1n/an/an/an/an/a8.022



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Assay Description
PARP assays utilizing SPA bead-based detection were carried out in 96-well plates. After reaction was terminated, the reaction mixtures were transfer...


J Med Chem 52: 514-23 (2009)


Article DOI: 10.1021/jm801171j
BindingDB Entry DOI: 10.7270/Q2DN43CK
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))
BDBM27094
PNG
(2-[(2R)-pyrrolidin-2-yl]-1H-1,3-benzodiazole-4-car...)
Show SMILES NC(=O)c1cccc2nc([nH]c12)[C@H]1CCCN1
Show InChI InChI=1S/C12H14N4O/c13-11(17)7-3-1-4-8-10(7)16-12(15-8)9-5-2-6-14-9/h1,3-4,9,14H,2,5-6H2,(H2,13,17)(H,15,16)/t9-/m1/s1
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7 -11.0n/an/an/an/an/a8.022



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Assay Description
PARP assays utilizing SPA bead-based detection were carried out in 96-well plates. After reaction was terminated, the reaction mixtures were transfer...


Bioorg Med Chem 16: 6965-75 (2008)


Article DOI: 10.1016/j.bmc.2008.05.044
BindingDB Entry DOI: 10.7270/Q2JD4V3X
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))
BDBM27094
PNG
(2-[(2R)-pyrrolidin-2-yl]-1H-1,3-benzodiazole-4-car...)
Show SMILES NC(=O)c1cccc2nc([nH]c12)[C@H]1CCCN1
Show InChI InChI=1S/C12H14N4O/c13-11(17)7-3-1-4-8-10(7)16-12(15-8)9-5-2-6-14-9/h1,3-4,9,14H,2,5-6H2,(H2,13,17)(H,15,16)/t9-/m1/s1
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7 -11.0n/an/an/an/an/a8.022



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Assay Description
PARP assays utilizing SPA bead-based detection were carried out in 96-well plates. After reaction was terminated, the reaction mixtures were transfer...


J Med Chem 52: 514-23 (2009)


Article DOI: 10.1021/jm801171j
BindingDB Entry DOI: 10.7270/Q2DN43CK
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))
BDBM27146
PNG
(2-(2-methylazetidin-2-yl)-1H-1,3-benzodiazole-4-ca...)
Show SMILES CC1(CCN1)c1nc2cccc(C(N)=O)c2[nH]1
Show InChI InChI=1S/C12H14N4O/c1-12(5-6-14-12)11-15-8-4-2-3-7(10(13)17)9(8)16-11/h2-4,14H,5-6H2,1H3,(H2,13,17)(H,15,16)
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13 -10.6n/an/an/an/an/a8.022



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Assay Description
PARP assays utilizing SPA bead-based detection were carried out in 96-well plates. After reaction was terminated, the reaction mixtures were transfer...


J Med Chem 52: 514-23 (2009)


Article DOI: 10.1021/jm801171j
BindingDB Entry DOI: 10.7270/Q2DN43CK
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))
BDBM27138
PNG
(2-(1-methylpyrrolidin-2-yl)-1H-1,3-benzodiazole-4-...)
Show SMILES CN1CCCC1c1nc2cccc(C(N)=O)c2[nH]1
Show InChI InChI=1S/C13H16N4O/c1-17-7-3-6-10(17)13-15-9-5-2-4-8(12(14)18)11(9)16-13/h2,4-5,10H,3,6-7H2,1H3,(H2,14,18)(H,15,16)
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15 -10.6n/an/an/an/an/a8.022



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Assay Description
PARP assays utilizing SPA bead-based detection were carried out in 96-well plates. After reaction was terminated, the reaction mixtures were transfer...


J Med Chem 52: 514-23 (2009)


Article DOI: 10.1021/jm801171j
BindingDB Entry DOI: 10.7270/Q2DN43CK
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))
BDBM27150
PNG
(2-[2-methyl-1-(propan-2-yl)pyrrolidin-2-yl]-1H-1,3...)
Show SMILES CC(C)N1CCCC1(C)c1nc2cccc(C(N)=O)c2[nH]1
Show InChI InChI=1S/C16H22N4O/c1-10(2)20-9-5-8-16(20,3)15-18-12-7-4-6-11(14(17)21)13(12)19-15/h4,6-7,10H,5,8-9H2,1-3H3,(H2,17,21)(H,18,19)
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17 -10.5n/an/an/an/an/a8.022



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Assay Description
PARP assays utilizing SPA bead-based detection were carried out in 96-well plates. After reaction was terminated, the reaction mixtures were transfer...


J Med Chem 52: 514-23 (2009)


Article DOI: 10.1021/jm801171j
BindingDB Entry DOI: 10.7270/Q2DN43CK
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))
BDBM27143
PNG
(2-(2-methyl-1-propylpiperidin-2-yl)-1H-1,3-benzodi...)
Show SMILES CCCN1CCCCC1(C)c1nc2cccc(C(N)=O)c2[nH]1
Show InChI InChI=1S/C17H24N4O/c1-3-10-21-11-5-4-9-17(21,2)16-19-13-8-6-7-12(15(18)22)14(13)20-16/h6-8H,3-5,9-11H2,1-2H3,(H2,18,22)(H,19,20)
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19 -10.4n/an/an/an/an/a8.022



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Assay Description
PARP assays utilizing SPA bead-based detection were carried out in 96-well plates. After reaction was terminated, the reaction mixtures were transfer...


J Med Chem 52: 514-23 (2009)


Article DOI: 10.1021/jm801171j
BindingDB Entry DOI: 10.7270/Q2DN43CK
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))
BDBM27142
PNG
(2-(piperidin-2-yl)-1H-1,3-benzodiazole-4-carboxami...)
Show SMILES NC(=O)c1cccc2nc([nH]c12)C1CCCCN1
Show InChI InChI=1S/C13H16N4O/c14-12(18)8-4-3-6-9-11(8)17-13(16-9)10-5-1-2-7-15-10/h3-4,6,10,15H,1-2,5,7H2,(H2,14,18)(H,16,17)
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25 -10.3n/an/an/an/an/a8.022



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Assay Description
PARP assays utilizing SPA bead-based detection were carried out in 96-well plates. After reaction was terminated, the reaction mixtures were transfer...


J Med Chem 52: 514-23 (2009)


Article DOI: 10.1021/jm801171j
BindingDB Entry DOI: 10.7270/Q2DN43CK
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))
BDBM27095
PNG
(2-[(2S)-pyrrolidin-2-yl]-1H-1,3-benzodiazole-4-car...)
Show SMILES NC(=O)c1cccc2nc([nH]c12)[C@@H]1CCCN1
Show InChI InChI=1S/C12H14N4O/c13-11(17)7-3-1-4-8-10(7)16-12(15-8)9-5-2-6-14-9/h1,3-4,9,14H,2,5-6H2,(H2,13,17)(H,15,16)/t9-/m0/s1
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30 -10.2n/an/an/an/an/a8.022



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Assay Description
PARP assays utilizing SPA bead-based detection were carried out in 96-well plates. After reaction was terminated, the reaction mixtures were transfer...


Bioorg Med Chem 16: 6965-75 (2008)


Article DOI: 10.1016/j.bmc.2008.05.044
BindingDB Entry DOI: 10.7270/Q2JD4V3X
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))
BDBM27095
PNG
(2-[(2S)-pyrrolidin-2-yl]-1H-1,3-benzodiazole-4-car...)
Show SMILES NC(=O)c1cccc2nc([nH]c12)[C@@H]1CCCN1
Show InChI InChI=1S/C12H14N4O/c13-11(17)7-3-1-4-8-10(7)16-12(15-8)9-5-2-6-14-9/h1,3-4,9,14H,2,5-6H2,(H2,13,17)(H,15,16)/t9-/m0/s1
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30 -10.2n/an/an/an/an/a8.022



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Assay Description
PARP assays utilizing SPA bead-based detection were carried out in 96-well plates. After reaction was terminated, the reaction mixtures were transfer...


J Med Chem 52: 514-23 (2009)


Article DOI: 10.1021/jm801171j
BindingDB Entry DOI: 10.7270/Q2DN43CK
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))
BDBM27151
PNG
(2-(1-cyclobutyl-2-methylpyrrolidin-2-yl)-1H-1,3-be...)
Show SMILES CC1(CCCN1C1CCC1)c1nc2cccc(C(N)=O)c2[nH]1
Show InChI InChI=1S/C17H22N4O/c1-17(9-4-10-21(17)11-5-2-6-11)16-19-13-8-3-7-12(15(18)22)14(13)20-16/h3,7-8,11H,2,4-6,9-10H2,1H3,(H2,18,22)(H,19,20)
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31 -10.1n/an/an/an/an/a8.022



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Assay Description
PARP assays utilizing SPA bead-based detection were carried out in 96-well plates. After reaction was terminated, the reaction mixtures were transfer...


J Med Chem 52: 514-23 (2009)


Article DOI: 10.1021/jm801171j
BindingDB Entry DOI: 10.7270/Q2DN43CK
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))
BDBM27092
PNG
(2-(azetidin-2-yl)-1H-1,3-benzodiazole-4-carboxamid...)
Show SMILES NC(=O)c1cccc2nc([nH]c12)C1CCN1
Show InChI InChI=1S/C11H12N4O/c12-10(16)6-2-1-3-7-9(6)15-11(14-7)8-4-5-13-8/h1-3,8,13H,4-5H2,(H2,12,16)(H,14,15)
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34 -10.1n/an/an/an/an/a8.022



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Assay Description
PARP assays utilizing SPA bead-based detection were carried out in 96-well plates. After reaction was terminated, the reaction mixtures were transfer...


Bioorg Med Chem 16: 6965-75 (2008)


Article DOI: 10.1016/j.bmc.2008.05.044
BindingDB Entry DOI: 10.7270/Q2JD4V3X
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))
BDBM27097
PNG
(2-[(2R)-piperidin-2-yl]-1H-1,3-benzodiazole-4-carb...)
Show SMILES NC(=O)c1cccc2nc([nH]c12)[C@H]1CCCCN1
Show InChI InChI=1S/C13H16N4O/c14-12(18)8-4-3-6-9-11(8)17-13(16-9)10-5-1-2-7-15-10/h3-4,6,10,15H,1-2,5,7H2,(H2,14,18)(H,16,17)/t10-/m1/s1
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37 -10.0n/an/an/an/an/a8.022



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Assay Description
PARP assays utilizing SPA bead-based detection were carried out in 96-well plates. After reaction was terminated, the reaction mixtures were transfer...


Bioorg Med Chem 16: 6965-75 (2008)


Article DOI: 10.1016/j.bmc.2008.05.044
BindingDB Entry DOI: 10.7270/Q2JD4V3X
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))
BDBM27098
PNG
(2-[(2S)-piperidin-2-yl]-1H-1,3-benzodiazole-4-carb...)
Show SMILES NC(=O)c1cccc2nc([nH]c12)[C@@H]1CCCCN1
Show InChI InChI=1S/C13H16N4O/c14-12(18)8-4-3-6-9-11(8)17-13(16-9)10-5-1-2-7-15-10/h3-4,6,10,15H,1-2,5,7H2,(H2,14,18)(H,16,17)/t10-/m0/s1
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41 -9.97n/an/an/an/an/a8.022



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Assay Description
PARP assays utilizing SPA bead-based detection were carried out in 96-well plates. After reaction was terminated, the reaction mixtures were transfer...


Bioorg Med Chem 16: 6965-75 (2008)


Article DOI: 10.1016/j.bmc.2008.05.044
BindingDB Entry DOI: 10.7270/Q2JD4V3X
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))
BDBM27144
PNG
(2-(1-propylpiperidin-2-yl)-1H-1,3-benzodiazole-4-c...)
Show SMILES CCCN1CCCCC1c1nc2cccc(C(N)=O)c2[nH]1
Show InChI InChI=1S/C16H22N4O/c1-2-9-20-10-4-3-8-13(20)16-18-12-7-5-6-11(15(17)21)14(12)19-16/h5-7,13H,2-4,8-10H2,1H3,(H2,17,21)(H,18,19)
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130 -9.29n/an/an/an/an/a8.022



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Assay Description
PARP assays utilizing SPA bead-based detection were carried out in 96-well plates. After reaction was terminated, the reaction mixtures were transfer...


J Med Chem 52: 514-23 (2009)


Article DOI: 10.1021/jm801171j
BindingDB Entry DOI: 10.7270/Q2DN43CK
More data for this
Ligand-Target Pair