Found 16 hits of Enzyme Inhibition Constant Data Target/Host (Institution) | Ligand | Target/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 | pH | Temp °C |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50145214
(2-(4-((methylamino)methyl)phenyl)-1H-benzo[d]imida...)Show InChI InChI=1S/C16H16N4O/c1-18-9-10-5-7-11(8-6-10)16-19-13-4-2-3-12(15(17)21)14(13)20-16/h2-8,18H,9H2,1H3,(H2,17,21)(H,19,20) | PDB MMDB
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 3.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Newcastle
Curated by ChEMBL
| Assay Description Binding affinity towards human poly(ADP-ribose) polymerase-1 (PARP-1) |
Bioorg Med Chem Lett 14: 2433-7 (2004)
Article DOI: 10.1016/j.bmcl.2004.03.017 BindingDB Entry DOI: 10.7270/Q2542N1M |
More data for this Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50145224
(2-(4-Dimethylaminomethyl-phenyl)-1H-benzoimidazole...)Show InChI InChI=1S/C17H18N4O/c1-21(2)10-11-6-8-12(9-7-11)17-19-14-5-3-4-13(16(18)22)15(14)20-17/h3-9H,10H2,1-2H3,(H2,18,22)(H,19,20) | PDB MMDB
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 4.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Newcastle
Curated by ChEMBL
| Assay Description Binding affinity towards human poly(ADP-ribose) polymerase-1 (PARP-1) |
Bioorg Med Chem Lett 14: 2433-7 (2004)
Article DOI: 10.1016/j.bmcl.2004.03.017 BindingDB Entry DOI: 10.7270/Q2542N1M |
More data for this Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50145216
(2-(4-{[Bis-(2-hydroxy-ethyl)-amino]-methyl}-phenyl...)Show SMILES NC(=O)c1cccc2[nH]c(nc12)-c1ccc(CN(CCO)CCO)cc1 Show InChI InChI=1S/C19H22N4O3/c20-18(26)15-2-1-3-16-17(15)22-19(21-16)14-6-4-13(5-7-14)12-23(8-10-24)9-11-25/h1-7,24-25H,8-12H2,(H2,20,26)(H,21,22) | PDB MMDB
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 4.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Newcastle
Curated by ChEMBL
| Assay Description Binding affinity towards human poly(ADP-ribose) polymerase-1 (PARP-1) |
Bioorg Med Chem Lett 14: 2433-7 (2004)
Article DOI: 10.1016/j.bmcl.2004.03.017 BindingDB Entry DOI: 10.7270/Q2542N1M |
More data for this Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50145223
(2-(3-Dimethylaminomethyl-phenyl)-1H-benzoimidazole...)Show InChI InChI=1S/C17H18N4O/c1-21(2)10-11-5-3-6-12(9-11)17-19-14-8-4-7-13(16(18)22)15(14)20-17/h3-9H,10H2,1-2H3,(H2,18,22)(H,19,20) | PDB MMDB
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 5.60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Newcastle
Curated by ChEMBL
| Assay Description Binding affinity towards human poly(ADP-ribose) polymerase-1 (PARP-1) |
Bioorg Med Chem Lett 14: 2433-7 (2004)
Article DOI: 10.1016/j.bmcl.2004.03.017 BindingDB Entry DOI: 10.7270/Q2542N1M |
More data for this Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50145221
(2-{4-[(4-Methoxy-benzyl)-methyl-amino]-phenyl}-1H-...)Show SMILES COc1ccc(CN(C)c2ccc(cc2)-c2nc3c(cccc3[nH]2)C(N)=O)cc1 Show InChI InChI=1S/C23H22N4O2/c1-27(14-15-6-12-18(29-2)13-7-15)17-10-8-16(9-11-17)23-25-20-5-3-4-19(22(24)28)21(20)26-23/h3-13H,14H2,1-2H3,(H2,24,28)(H,25,26) | PDB MMDB
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| 5.90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Newcastle
Curated by ChEMBL
| Assay Description Binding affinity towards human poly(ADP-ribose) polymerase-1 (PARP-1) |
Bioorg Med Chem Lett 14: 2433-7 (2004)
Article DOI: 10.1016/j.bmcl.2004.03.017 BindingDB Entry DOI: 10.7270/Q2542N1M |
More data for this Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50145225
(2-(4-Pyrrolidin-1-ylmethyl-phenyl)-1H-benzoimidazo...)Show SMILES NC(=O)c1cccc2[nH]c(nc12)-c1ccc(CN2CCCC2)cc1 Show InChI InChI=1S/C19H20N4O/c20-18(24)15-4-3-5-16-17(15)22-19(21-16)14-8-6-13(7-9-14)12-23-10-1-2-11-23/h3-9H,1-2,10-12H2,(H2,20,24)(H,21,22) | PDB MMDB
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 5.90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Newcastle
Curated by ChEMBL
| Assay Description Binding affinity towards human poly(ADP-ribose) polymerase-1 (PARP-1) |
Bioorg Med Chem Lett 14: 2433-7 (2004)
Article DOI: 10.1016/j.bmcl.2004.03.017 BindingDB Entry DOI: 10.7270/Q2542N1M |
More data for this Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50145219
(2-(4-Piperidin-1-ylmethyl-phenyl)-1H-benzoimidazol...)Show SMILES NC(=O)c1cccc2[nH]c(nc12)-c1ccc(CN2CCCCC2)cc1 Show InChI InChI=1S/C20H22N4O/c21-19(25)16-5-4-6-17-18(16)23-20(22-17)15-9-7-14(8-10-15)13-24-11-2-1-3-12-24/h4-10H,1-3,11-13H2,(H2,21,25)(H,22,23) | PDB MMDB
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 7.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Newcastle
Curated by ChEMBL
| Assay Description Binding affinity towards human poly(ADP-ribose) polymerase-1 (PARP-1) |
Bioorg Med Chem Lett 14: 2433-7 (2004)
Article DOI: 10.1016/j.bmcl.2004.03.017 BindingDB Entry DOI: 10.7270/Q2542N1M |
More data for this Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50145215
(2-[4-(4-Methyl-piperazin-1-ylmethyl)-phenyl]-1H-be...)Show SMILES CN1CCN(Cc2ccc(cc2)-c2nc3c(cccc3[nH]2)C(N)=O)CC1 Show InChI InChI=1S/C20H23N5O/c1-24-9-11-25(12-10-24)13-14-5-7-15(8-6-14)20-22-17-4-2-3-16(19(21)26)18(17)23-20/h2-8H,9-13H2,1H3,(H2,21,26)(H,22,23) | PDB MMDB
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 8.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Newcastle
Curated by ChEMBL
| Assay Description Binding affinity towards human poly(ADP-ribose) polymerase-1 (PARP-1) |
Bioorg Med Chem Lett 14: 2433-7 (2004)
Article DOI: 10.1016/j.bmcl.2004.03.017 BindingDB Entry DOI: 10.7270/Q2542N1M |
More data for this Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50145222
(2-[3-(4-Methyl-piperazin-1-ylmethyl)-phenyl]-1H-be...)Show SMILES CN1CCN(Cc2cccc(c2)-c2nc3c(cccc3[nH]2)C(N)=O)CC1 Show InChI InChI=1S/C20H23N5O/c1-24-8-10-25(11-9-24)13-14-4-2-5-15(12-14)20-22-17-7-3-6-16(19(21)26)18(17)23-20/h2-7,12H,8-11,13H2,1H3,(H2,21,26)(H,22,23) | PDB MMDB
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 9.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Newcastle
Curated by ChEMBL
| Assay Description Binding affinity towards human poly(ADP-ribose) polymerase-1 (PARP-1) |
Bioorg Med Chem Lett 14: 2433-7 (2004)
Article DOI: 10.1016/j.bmcl.2004.03.017 BindingDB Entry DOI: 10.7270/Q2542N1M |
More data for this Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50145220
(2-(3-Pyrrolidin-1-ylmethyl-phenyl)-1H-benzoimidazo...)Show SMILES NC(=O)c1cccc2[nH]c(nc12)-c1cccc(CN2CCCC2)c1 Show InChI InChI=1S/C19H20N4O/c20-18(24)15-7-4-8-16-17(15)22-19(21-16)14-6-3-5-13(11-14)12-23-9-1-2-10-23/h3-8,11H,1-2,9-10,12H2,(H2,20,24)(H,21,22) | PDB MMDB
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Newcastle
Curated by ChEMBL
| Assay Description Binding affinity towards human poly(ADP-ribose) polymerase-1 (PARP-1) |
Bioorg Med Chem Lett 14: 2433-7 (2004)
Article DOI: 10.1016/j.bmcl.2004.03.017 BindingDB Entry DOI: 10.7270/Q2542N1M |
More data for this Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50145218
(2-(3-Piperidin-1-ylmethyl-phenyl)-1H-benzoimidazol...)Show SMILES NC(=O)c1cccc2[nH]c(nc12)-c1cccc(CN2CCCCC2)c1 Show InChI InChI=1S/C20H22N4O/c21-19(25)16-8-5-9-17-18(16)23-20(22-17)15-7-4-6-14(12-15)13-24-10-2-1-3-11-24/h4-9,12H,1-3,10-11,13H2,(H2,21,25)(H,22,23) | PDB MMDB
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 12 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Newcastle
Curated by ChEMBL
| Assay Description Binding affinity towards human poly(ADP-ribose) polymerase-1 (PARP-1) |
Bioorg Med Chem Lett 14: 2433-7 (2004)
Article DOI: 10.1016/j.bmcl.2004.03.017 BindingDB Entry DOI: 10.7270/Q2542N1M |
More data for this Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50145217
(2-(4-Morpholin-4-ylmethyl-phenyl)-1H-benzoimidazol...)Show SMILES NC(=O)c1cccc2[nH]c(nc12)-c1ccc(CN2CCOCC2)cc1 Show InChI InChI=1S/C19H20N4O2/c20-18(24)15-2-1-3-16-17(15)22-19(21-16)14-6-4-13(5-7-14)12-23-8-10-25-11-9-23/h1-7H,8-12H2,(H2,20,24)(H,21,22) | PDB MMDB
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 12 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Newcastle
Curated by ChEMBL
| Assay Description Binding affinity towards human poly(ADP-ribose) polymerase-1 (PARP-1) |
Bioorg Med Chem Lett 14: 2433-7 (2004)
Article DOI: 10.1016/j.bmcl.2004.03.017 BindingDB Entry DOI: 10.7270/Q2542N1M |
More data for this Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM27091
(2-phenyl-1H-1,3-benzodiazole-4-carboxamide | CHEMB...)Show InChI InChI=1S/C14H11N3O/c15-13(18)10-7-4-8-11-12(10)17-14(16-11)9-5-2-1-3-6-9/h1-8H,(H2,15,18)(H,16,17) | PDB MMDB
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| 15 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Newcastle
Curated by ChEMBL
| Assay Description Binding affinity towards human poly(ADP-ribose) polymerase-1 (PARP-1) |
Bioorg Med Chem Lett 14: 2433-7 (2004)
Article DOI: 10.1016/j.bmcl.2004.03.017 BindingDB Entry DOI: 10.7270/Q2542N1M |
More data for this Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50145212
(2-(3-Morpholin-4-ylmethyl-phenyl)-1H-benzoimidazol...)Show SMILES NC(=O)c1cccc2[nH]c(nc12)-c1cccc(CN2CCOCC2)c1 Show InChI InChI=1S/C19H20N4O2/c20-18(24)15-5-2-6-16-17(15)22-19(21-16)14-4-1-3-13(11-14)12-23-7-9-25-10-8-23/h1-6,11H,7-10,12H2,(H2,20,24)(H,21,22) | PDB MMDB
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 31 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Newcastle
Curated by ChEMBL
| Assay Description Binding affinity towards human poly(ADP-ribose) polymerase-1 (PARP-1) |
Bioorg Med Chem Lett 14: 2433-7 (2004)
Article DOI: 10.1016/j.bmcl.2004.03.017 BindingDB Entry DOI: 10.7270/Q2542N1M |
More data for this Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50145213
(2-(3-{[Bis-(2-hydroxy-ethyl)-amino]-methyl}-phenyl...)Show SMILES NC(=O)c1cccc2[nH]c(nc12)-c1cccc(CN(CCO)CCO)c1 Show InChI InChI=1S/C19H22N4O3/c20-18(26)15-5-2-6-16-17(15)22-19(21-16)14-4-1-3-13(11-14)12-23(7-9-24)8-10-25/h1-6,11,24-25H,7-10,12H2,(H2,20,26)(H,21,22) | PDB MMDB
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 272 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Newcastle
Curated by ChEMBL
| Assay Description Binding affinity towards human poly(ADP-ribose) polymerase-1 (PARP-1) |
Bioorg Med Chem Lett 14: 2433-7 (2004)
Article DOI: 10.1016/j.bmcl.2004.03.017 BindingDB Entry DOI: 10.7270/Q2542N1M |
More data for this Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM27506
(3-AB | 3-aminobenzamide | CHEMBL81977)Show InChI InChI=1S/C7H8N2O/c8-6-3-1-2-5(4-6)7(9)10/h1-4H,8H2,(H2,9,10) | PDB MMDB
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE MMDB PC cid PC sid PDB UniChem
Patents
| Article PubMed
| 3.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Newcastle
Curated by ChEMBL
| Assay Description Binding affinity towards human poly(ADP-ribose) polymerase-1 (PARP-1) |
Bioorg Med Chem Lett 14: 2433-7 (2004)
Article DOI: 10.1016/j.bmcl.2004.03.017 BindingDB Entry DOI: 10.7270/Q2542N1M |
More data for this Ligand-Target Pair | |