Found 30 hits Enz. Inhib. hit(s) with all data for entry = 50016145 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)) | BDBM50165496
(1-(2-fluoro-5-((4-oxo-3,4-dihydrophthalazin-1-yl)m...)Show SMILES Cc1cc(O)n(c1O)-c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F |(2.63,-45.05,;1.1,-44.9,;.32,-43.57,;-1.18,-43.9,;-2.34,-42.88,;-1.33,-45.44,;.08,-46.05,;.41,-47.56,;-2.66,-46.22,;-3.99,-45.46,;-5.31,-46.24,;-6.65,-45.47,;-6.65,-43.93,;-5.32,-43.16,;-5.32,-41.61,;-6.67,-40.84,;-6.68,-39.3,;-8,-41.62,;-9.34,-40.86,;-10.66,-41.63,;-10.67,-43.18,;-9.33,-43.95,;-7.99,-43.17,;-5.31,-47.78,;-3.98,-48.54,;-2.65,-47.77,;-1.31,-48.53,)| Show InChI InChI=1S/C20H16FN3O3/c1-11-8-18(25)24(20(11)27)17-10-12(6-7-15(17)21)9-16-13-4-2-3-5-14(13)19(26)23-22-16/h2-8,10,25,27H,9H2,1H3,(H,23,26) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 3.80 | n/a | n/a | n/a | n/a | n/a | n/a |
KuDOS Horsham Ltd
Curated by ChEMBL
| Assay Description
Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1) |
Bioorg Med Chem Lett 15: 2235-8 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.026
BindingDB Entry DOI: 10.7270/Q2QV3M0B |
More data for this
Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50165488
(1-(2-fluoro-5-((4-oxo-3,4-dihydrophthalazin-1-yl)m...)Show SMILES Fc1ccc(Cc2n[nH]c(=O)c3ccccc23)cc1N1C(=O)CCCC1=O Show InChI InChI=1S/C20H16FN3O3/c21-15-9-8-12(11-17(15)24-18(25)6-3-7-19(24)26)10-16-13-4-1-2-5-14(13)20(27)23-22-16/h1-2,4-5,8-9,11H,3,6-7,10H2,(H,23,27) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 4.10 | n/a | n/a | n/a | n/a | n/a | n/a |
KuDOS Horsham Ltd
Curated by ChEMBL
| Assay Description
Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1) |
Bioorg Med Chem Lett 15: 2235-8 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.026
BindingDB Entry DOI: 10.7270/Q2QV3M0B |
More data for this
Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50165486
(1-(2-fluoro-5-((4-oxo-3,4-dihydrophthalazin-1-yl)m...)Show SMILES Oc1ccc(O)n1-c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F |(35.28,-33.78,;34.95,-32.28,;35.97,-31.13,;35.19,-29.8,;33.69,-30.13,;32.54,-29.11,;33.55,-31.67,;32.22,-32.45,;30.88,-31.69,;29.56,-32.47,;28.22,-31.7,;28.22,-30.16,;29.56,-29.39,;29.55,-27.84,;28.2,-27.07,;28.19,-25.53,;26.87,-27.85,;25.53,-27.09,;24.21,-27.86,;24.21,-29.4,;25.54,-30.17,;26.88,-29.4,;29.56,-34,;30.89,-34.77,;32.23,-33.99,;33.56,-34.76,)| Show InChI InChI=1S/C19H14FN3O3/c20-14-6-5-11(10-16(14)23-17(24)7-8-18(23)25)9-15-12-3-1-2-4-13(12)19(26)22-21-15/h1-8,10,24-25H,9H2,(H,22,26) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
KuDOS Horsham Ltd
Curated by ChEMBL
| Assay Description
Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1) |
Bioorg Med Chem Lett 15: 2235-8 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.026
BindingDB Entry DOI: 10.7270/Q2QV3M0B |
More data for this
Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50165497
(3-[2-Fluoro-5-(4-oxo-3,4-dihydro-phthalazin-1-ylme...)Show SMILES Oc1c2Cc2c(O)n1-c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F |(1.35,.12,;2.5,-.91,;4,-.58,;5.54,-.58,;4.77,-1.92,;3.74,-3.06,;3.97,-4.57,;2.34,-2.43,;1.01,-3.22,;-.32,-2.45,;-1.66,-3.22,;-2.99,-2.45,;-2.99,-.91,;-1.65,-.14,;-1.65,1.4,;-2.99,2.17,;-2.99,3.71,;-4.32,1.4,;-5.65,2.17,;-6.99,1.4,;-6.99,-.14,;-5.65,-.91,;-4.32,-.14,;-1.66,-4.77,;-.33,-5.54,;1.01,-4.77,;2.36,-5.54,)| Show InChI InChI=1S/C20H14FN3O3/c21-15-6-5-10(8-17(15)24-19(26)13-9-14(13)20(24)27)7-16-11-3-1-2-4-12(11)18(25)23-22-16/h1-6,8,26-27H,7,9H2,(H,23,25) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
KuDOS Horsham Ltd
Curated by ChEMBL
| Assay Description
Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1) |
Bioorg Med Chem Lett 15: 2235-8 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.026
BindingDB Entry DOI: 10.7270/Q2QV3M0B |
More data for this
Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50165498
(1-(2-fluoro-5-((4-oxo-3,4-dihydrophthalazin-1-yl)m...)Show SMILES Oc1cc(c(O)n1-c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F)-c1ccccc1 |(14.66,-43.53,;15.81,-44.55,;17.31,-44.22,;18.09,-45.55,;17.07,-46.7,;17.4,-48.2,;15.67,-46.09,;14.34,-46.87,;13,-46.11,;11.68,-46.89,;10.34,-46.12,;10.34,-44.58,;11.68,-43.8,;11.67,-42.26,;10.32,-41.48,;10.31,-39.94,;8.99,-42.27,;7.65,-41.51,;6.33,-42.28,;6.33,-43.82,;7.66,-44.59,;9,-43.82,;11.68,-48.42,;13.01,-49.19,;14.35,-48.41,;15.68,-49.18,;19.63,-45.56,;20.38,-46.9,;21.92,-46.92,;22.71,-45.59,;21.94,-44.24,;20.41,-44.23,)| Show InChI InChI=1S/C25H18FN3O3/c26-20-11-10-15(12-21-17-8-4-5-9-18(17)24(31)28-27-21)13-22(20)29-23(30)14-19(25(29)32)16-6-2-1-3-7-16/h1-11,13-14,30,32H,12H2,(H,28,31) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 6.80 | n/a | n/a | n/a | n/a | n/a | n/a |
KuDOS Horsham Ltd
Curated by ChEMBL
| Assay Description
Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1) |
Bioorg Med Chem Lett 15: 2235-8 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.026
BindingDB Entry DOI: 10.7270/Q2QV3M0B |
More data for this
Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50165492
(1-[2-Fluoro-5-(4-oxo-3,4-dihydro-phthalazin-1-ylme...)Show SMILES CN1CC(=O)N(C(=O)C1)c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F Show InChI InChI=1S/C20H17FN4O3/c1-24-10-18(26)25(19(27)11-24)17-9-12(6-7-15(17)21)8-16-13-4-2-3-5-14(13)20(28)23-22-16/h2-7,9H,8,10-11H2,1H3,(H,23,28) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 9.5 | n/a | n/a | n/a | n/a | n/a | n/a |
KuDOS Horsham Ltd
Curated by ChEMBL
| Assay Description
Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1) |
Bioorg Med Chem Lett 15: 2235-8 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.026
BindingDB Entry DOI: 10.7270/Q2QV3M0B |
More data for this
Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50165479
(1-[2-Fluoro-5-(4-oxo-3,4-dihydro-phthalazin-1-ylme...)Show SMILES CC1(C)CC(=O)N(C1=O)c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F Show InChI InChI=1S/C21H18FN3O3/c1-21(2)11-18(26)25(20(21)28)17-10-12(7-8-15(17)22)9-16-13-5-3-4-6-14(13)19(27)24-23-16/h3-8,10H,9,11H2,1-2H3,(H,24,27) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 9.80 | n/a | n/a | n/a | n/a | n/a | n/a |
KuDOS Horsham Ltd
Curated by ChEMBL
| Assay Description
Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1) |
Bioorg Med Chem Lett 15: 2235-8 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.026
BindingDB Entry DOI: 10.7270/Q2QV3M0B |
More data for this
Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50165499
(1-(4-Methoxy-phenyl)-3-methyl-1H-pyrazole-4-carbox...)Show SMILES COc1ccc(cc1)-n1cc(C(=O)Nc2cccc(Cc3n[nH]c(=O)c4ccccc34)c2)c(C)n1 Show InChI InChI=1S/C27H23N5O3/c1-17-24(16-32(31-17)20-10-12-21(35-2)13-11-20)26(33)28-19-7-5-6-18(14-19)15-25-22-8-3-4-9-23(22)27(34)30-29-25/h3-14,16H,15H2,1-2H3,(H,28,33)(H,30,34) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
KuDOS Horsham Ltd
Curated by ChEMBL
| Assay Description
Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1) |
Bioorg Med Chem Lett 15: 2235-8 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.026
BindingDB Entry DOI: 10.7270/Q2QV3M0B |
More data for this
Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50165478
(1-(3-((4-oxo-3,4-dihydrophthalazin-1-yl)methyl)phe...)Show SMILES Oc1ccc(O)n1-c1cccc(Cc2n[nH]c(=O)c3ccccc23)c1 Show InChI InChI=1S/C19H15N3O3/c23-17-8-9-18(24)22(17)13-5-3-4-12(10-13)11-16-14-6-1-2-7-15(14)19(25)21-20-16/h1-10,23-24H,11H2,(H,21,25) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
KuDOS Horsham Ltd
Curated by ChEMBL
| Assay Description
Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1) |
Bioorg Med Chem Lett 15: 2235-8 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.026
BindingDB Entry DOI: 10.7270/Q2QV3M0B |
More data for this
Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50165485
(2,2,2-Trifluoro-N-[3-(4-oxo-3,4-dihydro-phthalazin...)Show SMILES FC(F)(F)C(=O)Nc1cccc(Cc2n[nH]c(=O)c3ccccc23)c1 Show InChI InChI=1S/C17H12F3N3O2/c18-17(19,20)16(25)21-11-5-3-4-10(8-11)9-14-12-6-1-2-7-13(12)15(24)23-22-14/h1-8H,9H2,(H,21,25)(H,23,24) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
KuDOS Horsham Ltd
Curated by ChEMBL
| Assay Description
Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1) |
Bioorg Med Chem Lett 15: 2235-8 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.026
BindingDB Entry DOI: 10.7270/Q2QV3M0B |
More data for this
Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50165487
(1-[3-(4-Oxo-3,4-dihydro-phthalazin-1-ylmethyl)-phe...)Show SMILES O=C1C=CC(=O)N1c1cccc(Cc2n[nH]c(=O)c3ccccc23)c1 |c:2| Show InChI InChI=1S/C19H13N3O3/c23-17-8-9-18(24)22(17)13-5-3-4-12(10-13)11-16-14-6-1-2-7-15(14)19(25)21-20-16/h1-10H,11H2,(H,21,25) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
KuDOS Horsham Ltd
Curated by ChEMBL
| Assay Description
Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1) |
Bioorg Med Chem Lett 15: 2235-8 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.026
BindingDB Entry DOI: 10.7270/Q2QV3M0B |
More data for this
Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50165472
(1-(2-chloro-5-((4-oxo-3,4-dihydrophthalazin-1-yl)m...)Show SMILES Oc1ccc(O)n1-c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1Cl |(18.5,-33.78,;18.16,-32.28,;19.19,-31.13,;18.41,-29.8,;16.9,-30.13,;15.75,-29.11,;16.76,-31.67,;15.43,-32.45,;14.1,-31.69,;12.77,-32.47,;11.44,-31.7,;11.43,-30.16,;12.77,-29.39,;12.76,-27.84,;11.42,-27.07,;11.41,-25.53,;10.09,-27.85,;8.75,-27.09,;7.42,-27.86,;7.42,-29.4,;8.75,-30.17,;10.1,-29.4,;12.77,-34,;14.11,-34.77,;15.44,-33.99,;16.78,-34.76,)| Show InChI InChI=1S/C19H14ClN3O3/c20-14-6-5-11(10-16(14)23-17(24)7-8-18(23)25)9-15-12-3-1-2-4-13(12)19(26)22-21-15/h1-8,10,24-25H,9H2,(H,22,26) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 19 | n/a | n/a | n/a | n/a | n/a | n/a |
KuDOS Horsham Ltd
Curated by ChEMBL
| Assay Description
Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1) |
Bioorg Med Chem Lett 15: 2235-8 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.026
BindingDB Entry DOI: 10.7270/Q2QV3M0B |
More data for this
Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50165477
(CHEMBL371425 | N-(3-((4-oxo-3,4-dihydrophthalazin-...)Show InChI InChI=1S/C18H17N3O2/c1-2-17(22)19-13-7-5-6-12(10-13)11-16-14-8-3-4-9-15(14)18(23)21-20-16/h3-10H,2,11H2,1H3,(H,19,22)(H,21,23) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
KuDOS Horsham Ltd
Curated by ChEMBL
| Assay Description
Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1) |
Bioorg Med Chem Lett 15: 2235-8 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.026
BindingDB Entry DOI: 10.7270/Q2QV3M0B |
More data for this
Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50165480
(4-Methyl-2-phenyl-thiazole-5-carboxylic acid [3-(4...)Show SMILES Cc1nc(sc1C(=O)Nc1cccc(Cc2n[nH]c(=O)c3ccccc23)c1)-c1ccccc1 Show InChI InChI=1S/C26H20N4O2S/c1-16-23(33-26(27-16)18-9-3-2-4-10-18)25(32)28-19-11-7-8-17(14-19)15-22-20-12-5-6-13-21(20)24(31)30-29-22/h2-14H,15H2,1H3,(H,28,32)(H,30,31) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 27 | n/a | n/a | n/a | n/a | n/a | n/a |
KuDOS Horsham Ltd
Curated by ChEMBL
| Assay Description
Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1) |
Bioorg Med Chem Lett 15: 2235-8 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.026
BindingDB Entry DOI: 10.7270/Q2QV3M0B |
More data for this
Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50165484
(1-(2-methoxy-5-((4-oxo-3,4-dihydrophthalazin-1-yl)...)Show SMILES COc1ccc(Cc2n[nH]c(=O)c3ccccc23)cc1-n1c(O)ccc1O |(-3.66,1.78,;-4.47,.48,;-3.75,-.88,;-2.22,-.93,;-1.48,-2.29,;-2.3,-3.61,;-1.58,-4.97,;-.04,-5.02,;.68,-6.38,;2.21,-6.44,;3.03,-5.13,;4.57,-5.19,;2.31,-3.77,;3.13,-2.47,;2.41,-1.1,;.86,-1.05,;.05,-2.35,;.77,-3.71,;-3.85,-3.55,;-4.57,-2.19,;-6.11,-2.13,;-7.06,-3.34,;-6.64,-4.82,;-8.51,-2.81,;-8.45,-1.27,;-6.97,-.85,;-6.44,.6,)| Show InChI InChI=1S/C20H17N3O4/c1-27-17-7-6-12(11-16(17)23-18(24)8-9-19(23)25)10-15-13-4-2-3-5-14(13)20(26)22-21-15/h2-9,11,24-25H,10H2,1H3,(H,22,26) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 33 | n/a | n/a | n/a | n/a | n/a | n/a |
KuDOS Horsham Ltd
Curated by ChEMBL
| Assay Description
Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1) |
Bioorg Med Chem Lett 15: 2235-8 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.026
BindingDB Entry DOI: 10.7270/Q2QV3M0B |
More data for this
Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50165474
(3-((4-oxo-3,4-dihydrophthalazin-1-yl)methyl)phenyl...)Show InChI InChI=1S/C17H14N2O3/c1-11(20)22-13-6-4-5-12(9-13)10-16-14-7-2-3-8-15(14)17(21)19-18-16/h2-9H,10H2,1H3,(H,19,21) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 36 | n/a | n/a | n/a | n/a | n/a | n/a |
KuDOS Horsham Ltd
Curated by ChEMBL
| Assay Description
Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1) |
Bioorg Med Chem Lett 15: 2235-8 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.026
BindingDB Entry DOI: 10.7270/Q2QV3M0B |
More data for this
Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50165495
(CHEMBL193903 | N-[3-(4-Oxo-3,4-dihydro-phthalazin-...)Show SMILES O=C(Nc1cccc(Cc2n[nH]c(=O)c3ccccc23)c1)c1ccc(nc1)-n1cccn1 Show InChI InChI=1S/C24H18N6O2/c31-23(17-9-10-22(25-15-17)30-12-4-11-26-30)27-18-6-3-5-16(13-18)14-21-19-7-1-2-8-20(19)24(32)29-28-21/h1-13,15H,14H2,(H,27,31)(H,29,32) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 47 | n/a | n/a | n/a | n/a | n/a | n/a |
KuDOS Horsham Ltd
Curated by ChEMBL
| Assay Description
Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1) |
Bioorg Med Chem Lett 15: 2235-8 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.026
BindingDB Entry DOI: 10.7270/Q2QV3M0B |
More data for this
Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50165483
(CHEMBL381208 | N-Ethyl-3-(4-oxo-3,4-dihydro-phthal...)Show InChI InChI=1S/C18H17N3O2/c1-2-19-17(22)13-7-5-6-12(10-13)11-16-14-8-3-4-9-15(14)18(23)21-20-16/h3-10H,2,11H2,1H3,(H,19,22)(H,21,23) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 50 | n/a | n/a | n/a | n/a | n/a | n/a |
KuDOS Horsham Ltd
Curated by ChEMBL
| Assay Description
Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1) |
Bioorg Med Chem Lett 15: 2235-8 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.026
BindingDB Entry DOI: 10.7270/Q2QV3M0B |
More data for this
Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50165471
(CHEMBL196507 | Cyclopropanecarboxylic acid [3-(4-o...)Show SMILES O=C(Nc1cccc(Cc2n[nH]c(=O)c3ccccc23)c1)C1CC1 Show InChI InChI=1S/C19H17N3O2/c23-18(13-8-9-13)20-14-5-3-4-12(10-14)11-17-15-6-1-2-7-16(15)19(24)22-21-17/h1-7,10,13H,8-9,11H2,(H,20,23)(H,22,24) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 55 | n/a | n/a | n/a | n/a | n/a | n/a |
KuDOS Horsham Ltd
Curated by ChEMBL
| Assay Description
Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1) |
Bioorg Med Chem Lett 15: 2235-8 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.026
BindingDB Entry DOI: 10.7270/Q2QV3M0B |
More data for this
Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50240980
(CHEMBL372450 | N-(3-((4-oxo-3,4-dihydrophthalazin-...)Show SMILES O=C(Nc1cccc(Cc2n[nH]c(=O)c3ccccc23)c1)c1ccc(s1)-c1ccsc1 Show InChI InChI=1S/C24H17N3O2S2/c28-23-19-7-2-1-6-18(19)20(26-27-23)13-15-4-3-5-17(12-15)25-24(29)22-9-8-21(31-22)16-10-11-30-14-16/h1-12,14H,13H2,(H,25,29)(H,27,28) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 56 | n/a | n/a | n/a | n/a | n/a | n/a |
KuDOS Horsham Ltd
Curated by ChEMBL
| Assay Description
Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1) |
Bioorg Med Chem Lett 15: 2235-8 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.026
BindingDB Entry DOI: 10.7270/Q2QV3M0B |
More data for this
Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50165494
(CHEMBL381652 | N-(3-((4-oxo-3,4-dihydrophthalazin-...)Show InChI InChI=1S/C17H15N3O2/c1-11(21)18-13-6-4-5-12(9-13)10-16-14-7-2-3-8-15(14)17(22)20-19-16/h2-9H,10H2,1H3,(H,18,21)(H,20,22) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 90 | n/a | n/a | n/a | n/a | n/a | n/a |
KuDOS Horsham Ltd
Curated by ChEMBL
| Assay Description
Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1) |
Bioorg Med Chem Lett 15: 2235-8 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.026
BindingDB Entry DOI: 10.7270/Q2QV3M0B |
More data for this
Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50165481
(CHEMBL425560 | N-(3-((4-oxo-3,4-dihydrophthalazin-...)Show InChI InChI=1S/C19H19N3O2/c1-2-6-18(23)20-14-8-5-7-13(11-14)12-17-15-9-3-4-10-16(15)19(24)22-21-17/h3-5,7-11H,2,6,12H2,1H3,(H,20,23)(H,22,24) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 90 | n/a | n/a | n/a | n/a | n/a | n/a |
KuDOS Horsham Ltd
Curated by ChEMBL
| Assay Description
Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1) |
Bioorg Med Chem Lett 15: 2235-8 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.026
BindingDB Entry DOI: 10.7270/Q2QV3M0B |
More data for this
Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50165493
(CHEMBL193638 | [3-(4-Oxo-3,4-dihydro-phthalazin-1-...)Show InChI InChI=1S/C18H17N3O3/c1-2-24-18(23)19-13-7-5-6-12(10-13)11-16-14-8-3-4-9-15(14)17(22)21-20-16/h3-10H,2,11H2,1H3,(H,19,23)(H,21,22) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 116 | n/a | n/a | n/a | n/a | n/a | n/a |
KuDOS Horsham Ltd
Curated by ChEMBL
| Assay Description
Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1) |
Bioorg Med Chem Lett 15: 2235-8 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.026
BindingDB Entry DOI: 10.7270/Q2QV3M0B |
More data for this
Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50165489
(4-(3-(2-oxopyrrolidin-1-yl)benzyl)phthalazin-1(2H)...)Show InChI InChI=1S/C19H17N3O2/c23-18-9-4-10-22(18)14-6-3-5-13(11-14)12-17-15-7-1-2-8-16(15)19(24)21-20-17/h1-3,5-8,11H,4,9-10,12H2,(H,21,24) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 120 | n/a | n/a | n/a | n/a | n/a | n/a |
KuDOS Horsham Ltd
Curated by ChEMBL
| Assay Description
Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1) |
Bioorg Med Chem Lett 15: 2235-8 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.026
BindingDB Entry DOI: 10.7270/Q2QV3M0B |
More data for this
Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50165482
(2-[3-(4-Oxo-3,4-dihydro-phthalazin-1-ylmethyl)-phe...)Show SMILES O=C1N(C(=O)c2ccccc12)c1cccc(Cc2n[nH]c(=O)c3ccccc23)c1 Show InChI InChI=1S/C23H15N3O3/c27-21-17-9-2-1-8-16(17)20(24-25-21)13-14-6-5-7-15(12-14)26-22(28)18-10-3-4-11-19(18)23(26)29/h1-12H,13H2,(H,25,27) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| n/a | n/a | 180 | n/a | n/a | n/a | n/a | n/a | n/a |
KuDOS Horsham Ltd
Curated by ChEMBL
| Assay Description
Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1) |
Bioorg Med Chem Lett 15: 2235-8 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.026
BindingDB Entry DOI: 10.7270/Q2QV3M0B |
More data for this
Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50165490
(4-[3-(3-Methyl-[1,2,4]oxadiazol-5-yl)-benzyl]-2H-p...)Show SMILES Cc1noc(n1)-c1cccc(Cc2n[nH]c(=O)c3ccccc23)c1 Show InChI InChI=1S/C18H14N4O2/c1-11-19-18(24-22-11)13-6-4-5-12(9-13)10-16-14-7-2-3-8-15(14)17(23)21-20-16/h2-9H,10H2,1H3,(H,21,23) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 189 | n/a | n/a | n/a | n/a | n/a | n/a |
KuDOS Horsham Ltd
Curated by ChEMBL
| Assay Description
Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1) |
Bioorg Med Chem Lett 15: 2235-8 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.026
BindingDB Entry DOI: 10.7270/Q2QV3M0B |
More data for this
Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50165491
(CHEMBL193917 | Ethanesulfonic acid [3-(4-oxo-3,4-d...)Show SMILES CCS(=O)(=O)Nc1cccc(Cc2n[nH]c(=O)c3ccccc23)c1 Show InChI InChI=1S/C17H17N3O3S/c1-2-24(22,23)20-13-7-5-6-12(10-13)11-16-14-8-3-4-9-15(14)17(21)19-18-16/h3-10,20H,2,11H2,1H3,(H,19,21) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 290 | n/a | n/a | n/a | n/a | n/a | n/a |
KuDOS Horsham Ltd
Curated by ChEMBL
| Assay Description
Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1) |
Bioorg Med Chem Lett 15: 2235-8 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.026
BindingDB Entry DOI: 10.7270/Q2QV3M0B |
More data for this
Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50165473
(CHEMBL193512 | N-[3-(4-Oxo-3,4-dihydro-phthalazin-...)Show SMILES CC(C)C(=O)Nc1cccc(Cc2n[nH]c(=O)c3ccccc23)c1 Show InChI InChI=1S/C19H19N3O2/c1-12(2)18(23)20-14-7-5-6-13(10-14)11-17-15-8-3-4-9-16(15)19(24)22-21-17/h3-10,12H,11H2,1-2H3,(H,20,23)(H,22,24) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 370 | n/a | n/a | n/a | n/a | n/a | n/a |
KuDOS Horsham Ltd
Curated by ChEMBL
| Assay Description
Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1) |
Bioorg Med Chem Lett 15: 2235-8 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.026
BindingDB Entry DOI: 10.7270/Q2QV3M0B |
More data for this
Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM50165475
(1-[3-(4-Oxo-3,4-dihydro-phthalazin-1-ylmethyl)-phe...)Show InChI InChI=1S/C19H20N4O2/c1-2-10-20-19(25)21-14-7-5-6-13(11-14)12-17-15-8-3-4-9-16(15)18(24)23-22-17/h3-9,11H,2,10,12H2,1H3,(H,23,24)(H2,20,21,25) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 540 | n/a | n/a | n/a | n/a | n/a | n/a |
KuDOS Horsham Ltd
Curated by ChEMBL
| Assay Description
Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1) |
Bioorg Med Chem Lett 15: 2235-8 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.026
BindingDB Entry DOI: 10.7270/Q2QV3M0B |
More data for this
Ligand-Target Pair | |
Poly [ADP-ribose] polymerase 1
(Homo sapiens (Human)) | BDBM27660
(4-Benzyl-2H-phthalazin-1-one | 4-benzyl-1,2-dihydr...)Show InChI InChI=1S/C15H12N2O/c18-15-13-9-5-4-8-12(13)14(16-17-15)10-11-6-2-1-3-7-11/h1-9H,10H2,(H,17,18) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 770 | n/a | n/a | n/a | n/a | n/a | n/a |
KuDOS Horsham Ltd
Curated by ChEMBL
| Assay Description
Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1) |
Bioorg Med Chem Lett 15: 2235-8 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.026
BindingDB Entry DOI: 10.7270/Q2QV3M0B |
More data for this
Ligand-Target Pair | |
Search and Browse
