Compile Data Set for Download or QSAR

Found 31 hits with Last Name = 'esposito' and Initial = 'c'   

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 tankyrase-2 (Homo sapiens (Human))	BDBM50540762 (CHEMBL4638701) Show SMILES O=c1[nH]c(SCCN2CCN(CCSc3nc4ccccc4c(=O)[nH]3)CC2)nc2ccccc12 Show InChI InChI=1S/C24H26N6O2S2/c31-21-17-5-1-3-7-19(17)25-23(27-21)33-15-13-29-9-11-30(12-10-29)14-16-34-24-26-20-8-4-2-6-18(20)22(32)28-24/h1-8H,9-16H2,(H,25,27,31)(H,26,28,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.300	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of full length human N-terminal GST-tagged TNKS2 ADP-ART catalytic domain (1001 to 1327 residues) using histone H2A as substrate incubated...				ACS Med Chem Lett 11: 862-868 (2020) Article DOI: 10.1021/acsmedchemlett.9b00654 BindingDB Entry DOI: 10.7270/Q21J9FBQ
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 (Homo sapiens (Human))	BDBM50540762 (CHEMBL4638701) Show SMILES O=c1[nH]c(SCCN2CCN(CCSc3nc4ccccc4c(=O)[nH]3)CC2)nc2ccccc12 Show InChI InChI=1S/C24H26N6O2S2/c31-21-17-5-1-3-7-19(17)25-23(27-21)33-15-13-29-9-11-30(12-10-29)14-16-34-24-26-20-8-4-2-6-18(20)22(32)28-24/h1-8H,9-16H2,(H,25,27,31)(H,26,28,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.10	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of full length human N-terminal GST-tagged TNKS1 ADP-ART catalytic domain (1001 to 1327 residues) using histone H2A as substrate incubated...				ACS Med Chem Lett 11: 862-868 (2020) Article DOI: 10.1021/acsmedchemlett.9b00654 BindingDB Entry DOI: 10.7270/Q21J9FBQ
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM27497 (2-(dimethylamino)-N-(6-oxo-5,6-dihydrophenanthridi...) Show SMILES CN(C)CC(=O)Nc1ccc2[nH]c(=O)c3ccccc3c2c1 Show InChI InChI=1S/C17H17N3O2/c1-20(2)10-16(21)18-11-7-8-15-14(9-11)12-5-3-4-6-13(12)17(22)19-15/h3-9H,10H2,1-2H3,(H,18,21)(H,19,22)	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	9.10	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of full length human C-terminal His-tagged PARP1 expressed in baculovirus infected Sf9 cells using chicken core histone as substrate incub...				ACS Med Chem Lett 11: 862-868 (2020) Article DOI: 10.1021/acsmedchemlett.9b00654 BindingDB Entry DOI: 10.7270/Q21J9FBQ
					More data for this Ligand-Target Pair				3D Structure (crystal)
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM50540757 (CHEMBL4460557) Show SMILES O=c1[nH]c(SCCN2CCN(CC2)c2ccccn2)nc2ccccc12 Show InChI InChI=1S/C19H21N5OS/c25-18-15-5-1-2-6-16(15)21-19(22-18)26-14-13-23-9-11-24(12-10-23)17-7-3-4-8-20-17/h1-8H,9-14H2,(H,21,22,25)	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	9.30	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of full length human C-terminal His-tagged PARP1 expressed in baculovirus infected Sf9 cells using chicken core histone as substrate incub...				ACS Med Chem Lett 11: 862-868 (2020) Article DOI: 10.1021/acsmedchemlett.9b00654 BindingDB Entry DOI: 10.7270/Q21J9FBQ
					More data for this Ligand-Target Pair				3D Structure (crystal)
Poly [ADP-ribose] polymerase tankyrase-2 (Homo sapiens (Human))	BDBM50540759 (CHEMBL4648016) Show SMILES O=c1[nH]c(SCCN2CCN(CCCc3nc(no3)-c3ccccc3)CC2)nc2ccccc12 Show InChI InChI=1S/C25H28N6O2S/c32-24-20-9-4-5-10-21(20)26-25(28-24)34-18-17-31-15-13-30(14-16-31)12-6-11-22-27-23(29-33-22)19-7-2-1-3-8-19/h1-5,7-10H,6,11-18H2,(H,26,28,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of full length human N-terminal GST-tagged TNKS2 ADP-ART catalytic domain (1001 to 1327 residues) using histone H2A as substrate incubated...				ACS Med Chem Lett 11: 862-868 (2020) Article DOI: 10.1021/acsmedchemlett.9b00654 BindingDB Entry DOI: 10.7270/Q21J9FBQ
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 2 (Homo sapiens (Human))	BDBM27497 (2-(dimethylamino)-N-(6-oxo-5,6-dihydrophenanthridi...) Show SMILES CN(C)CC(=O)Nc1ccc2[nH]c(=O)c3ccccc3c2c1 Show InChI InChI=1S/C17H17N3O2/c1-20(2)10-16(21)18-11-7-8-15-14(9-11)12-5-3-4-6-13(12)17(22)19-15/h3-9H,10H2,1-2H3,(H,18,21)(H,19,22)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of full length human N-terminal His-tagged PARP2 expressed in baculovirus infected Sf9 cells using histone H3.3 as substrate incubated for...				ACS Med Chem Lett 11: 862-868 (2020) Article DOI: 10.1021/acsmedchemlett.9b00654 BindingDB Entry DOI: 10.7270/Q21J9FBQ
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-2 (Homo sapiens (Human))	BDBM50294835 (4-((1S,2S,6R,7R)-3,5-Dioxo-4-aza-tricyclo[5.2.1.0*...) Show SMILES Oc1c2[C@H]3C[C@H](C=C3)c2c(O)n1-c1ccc(cc1)C(=O)Nc1cccc2cccnc12 |r,c:6| Show InChI InChI=1S/C25H19N3O3/c29-23(27-19-5-1-3-14-4-2-12-26-22(14)19)15-8-10-18(11-9-15)28-24(30)20-16-6-7-17(13-16)21(20)25(28)31/h1-12,16-17,30-31H,13H2,(H,27,29)/t16-,17+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	29	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of full length human N-terminal GST-tagged TNKS2 ADP-ART catalytic domain (1001 to 1327 residues) using histone H2A as substrate incubated...				ACS Med Chem Lett 11: 862-868 (2020) Article DOI: 10.1021/acsmedchemlett.9b00654 BindingDB Entry DOI: 10.7270/Q21J9FBQ
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 (Homo sapiens (Human))	BDBM50540759 (CHEMBL4648016) Show SMILES O=c1[nH]c(SCCN2CCN(CCCc3nc(no3)-c3ccccc3)CC2)nc2ccccc12 Show InChI InChI=1S/C25H28N6O2S/c32-24-20-9-4-5-10-21(20)26-25(28-24)34-18-17-31-15-13-30(14-16-31)12-6-11-22-27-23(29-33-22)19-7-2-1-3-8-19/h1-5,7-10H,6,11-18H2,(H,26,28,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	37	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of full length human N-terminal GST-tagged TNKS1 ADP-ART catalytic domain (1001 to 1327 residues) using histone H2A as substrate incubated...				ACS Med Chem Lett 11: 862-868 (2020) Article DOI: 10.1021/acsmedchemlett.9b00654 BindingDB Entry DOI: 10.7270/Q21J9FBQ
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 2 (Homo sapiens (Human))	BDBM50540762 (CHEMBL4638701) Show SMILES O=c1[nH]c(SCCN2CCN(CCSc3nc4ccccc4c(=O)[nH]3)CC2)nc2ccccc12 Show InChI InChI=1S/C24H26N6O2S2/c31-21-17-5-1-3-7-19(17)25-23(27-21)33-15-13-29-9-11-30(12-10-29)14-16-34-24-26-20-8-4-2-6-18(20)22(32)28-24/h1-8H,9-16H2,(H,25,27,31)(H,26,28,32)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	38	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of full length human N-terminal His-tagged PARP2 expressed in baculovirus infected Sf9 cells using histone H3.3 as substrate incubated for...				ACS Med Chem Lett 11: 862-868 (2020) Article DOI: 10.1021/acsmedchemlett.9b00654 BindingDB Entry DOI: 10.7270/Q21J9FBQ
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 (Homo sapiens (Human))	BDBM27497 (2-(dimethylamino)-N-(6-oxo-5,6-dihydrophenanthridi...) Show SMILES CN(C)CC(=O)Nc1ccc2[nH]c(=O)c3ccccc3c2c1 Show InChI InChI=1S/C17H17N3O2/c1-20(2)10-16(21)18-11-7-8-15-14(9-11)12-5-3-4-6-13(12)17(22)19-15/h3-9H,10H2,1-2H3,(H,18,21)(H,19,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	39	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of full length human N-terminal GST-tagged TNKS1 ADP-ART catalytic domain (1001 to 1327 residues) using histone H2A as substrate incubated...				ACS Med Chem Lett 11: 862-868 (2020) Article DOI: 10.1021/acsmedchemlett.9b00654 BindingDB Entry DOI: 10.7270/Q21J9FBQ
					More data for this Ligand-Target Pair				3D Structure (crystal)
Poly [ADP-ribose] polymerase tankyrase-2 (Homo sapiens (Human))	BDBM27497 (2-(dimethylamino)-N-(6-oxo-5,6-dihydrophenanthridi...) Show SMILES CN(C)CC(=O)Nc1ccc2[nH]c(=O)c3ccccc3c2c1 Show InChI InChI=1S/C17H17N3O2/c1-20(2)10-16(21)18-11-7-8-15-14(9-11)12-5-3-4-6-13(12)17(22)19-15/h3-9H,10H2,1-2H3,(H,18,21)(H,19,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	53	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of full length human N-terminal GST-tagged TNKS2 ADP-ART catalytic domain (1001 to 1327 residues) using histone H2A as substrate incubated...				ACS Med Chem Lett 11: 862-868 (2020) Article DOI: 10.1021/acsmedchemlett.9b00654 BindingDB Entry DOI: 10.7270/Q21J9FBQ
					More data for this Ligand-Target Pair				3D Structure (crystal)
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM50540762 (CHEMBL4638701) Show SMILES O=c1[nH]c(SCCN2CCN(CCSc3nc4ccccc4c(=O)[nH]3)CC2)nc2ccccc12 Show InChI InChI=1S/C24H26N6O2S2/c31-21-17-5-1-3-7-19(17)25-23(27-21)33-15-13-29-9-11-30(12-10-29)14-16-34-24-26-20-8-4-2-6-18(20)22(32)28-24/h1-8H,9-16H2,(H,25,27,31)(H,26,28,32)	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	90	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of full length human C-terminal His-tagged PARP1 expressed in baculovirus infected Sf9 cells using chicken core histone as substrate incub...				ACS Med Chem Lett 11: 862-868 (2020) Article DOI: 10.1021/acsmedchemlett.9b00654 BindingDB Entry DOI: 10.7270/Q21J9FBQ
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-2 (Homo sapiens (Human))	BDBM50540760 (CHEMBL4632484) Show SMILES O=C(CN1CCN(CCSc2nc3ccccc3c(=O)[nH]2)CC1)N1CCC2(CC1)CC(=O)c1ccccc1O2 Show InChI InChI=1S/C29H33N5O4S/c35-24-19-29(38-25-8-4-2-6-22(24)25)9-11-34(12-10-29)26(36)20-33-15-13-32(14-16-33)17-18-39-28-30-23-7-3-1-5-21(23)27(37)31-28/h1-8H,9-20H2,(H,30,31,37)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	103	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of full length human N-terminal GST-tagged TNKS2 ADP-ART catalytic domain (1001 to 1327 residues) using histone H2A as substrate incubated...				ACS Med Chem Lett 11: 862-868 (2020) Article DOI: 10.1021/acsmedchemlett.9b00654 BindingDB Entry DOI: 10.7270/Q21J9FBQ
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-2 (Homo sapiens (Human))	BDBM50540757 (CHEMBL4460557) Show SMILES O=c1[nH]c(SCCN2CCN(CC2)c2ccccn2)nc2ccccc12 Show InChI InChI=1S/C19H21N5OS/c25-18-15-5-1-2-6-16(15)21-19(22-18)26-14-13-23-9-11-24(12-10-23)17-7-3-4-8-20-17/h1-8H,9-14H2,(H,21,22,25)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	193	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of full length human N-terminal GST-tagged TNKS2 ADP-ART catalytic domain (1001 to 1327 residues) using histone H2A as substrate incubated...				ACS Med Chem Lett 11: 862-868 (2020) Article DOI: 10.1021/acsmedchemlett.9b00654 BindingDB Entry DOI: 10.7270/Q21J9FBQ
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 (Homo sapiens (Human))	BDBM50540757 (CHEMBL4460557) Show SMILES O=c1[nH]c(SCCN2CCN(CC2)c2ccccn2)nc2ccccc12 Show InChI InChI=1S/C19H21N5OS/c25-18-15-5-1-2-6-16(15)21-19(22-18)26-14-13-23-9-11-24(12-10-23)17-7-3-4-8-20-17/h1-8H,9-14H2,(H,21,22,25)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	218	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of full length human N-terminal GST-tagged TNKS1 ADP-ART catalytic domain (1001 to 1327 residues) using histone H2A as substrate incubated...				ACS Med Chem Lett 11: 862-868 (2020) Article DOI: 10.1021/acsmedchemlett.9b00654 BindingDB Entry DOI: 10.7270/Q21J9FBQ
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 (Homo sapiens (Human))	BDBM50294835 (4-((1S,2S,6R,7R)-3,5-Dioxo-4-aza-tricyclo[5.2.1.0*...) Show SMILES Oc1c2[C@H]3C[C@H](C=C3)c2c(O)n1-c1ccc(cc1)C(=O)Nc1cccc2cccnc12 |r,c:6| Show InChI InChI=1S/C25H19N3O3/c29-23(27-19-5-1-3-14-4-2-12-26-22(14)19)15-8-10-18(11-9-15)28-24(30)20-16-6-7-17(13-16)21(20)25(28)31/h1-12,16-17,30-31H,13H2,(H,27,29)/t16-,17+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	303	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of full length human N-terminal GST-tagged TNKS1 ADP-ART catalytic domain (1001 to 1327 residues) using histone H2A as substrate incubated...				ACS Med Chem Lett 11: 862-868 (2020) Article DOI: 10.1021/acsmedchemlett.9b00654 BindingDB Entry DOI: 10.7270/Q21J9FBQ
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-2 (Homo sapiens (Human))	BDBM50540761 (CHEMBL4641894) Show SMILES O=C(OCc1ccccc1)N1CCN(CCSc2nc3ccccc3c(=O)[nH]2)CC1 Show InChI InChI=1S/C22H24N4O3S/c27-20-18-8-4-5-9-19(18)23-21(24-20)30-15-14-25-10-12-26(13-11-25)22(28)29-16-17-6-2-1-3-7-17/h1-9H,10-16H2,(H,23,24,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	318	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of full length human N-terminal GST-tagged TNKS2 ADP-ART catalytic domain (1001 to 1327 residues) using histone H2A as substrate incubated...				ACS Med Chem Lett 11: 862-868 (2020) Article DOI: 10.1021/acsmedchemlett.9b00654 BindingDB Entry DOI: 10.7270/Q21J9FBQ
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 2 (Homo sapiens (Human))	BDBM50540758 (CHEMBL4642139) Show SMILES O=c1[nH]c(SCCN2CCN(CCCOc3ccc(cc3)-c3ccccc3)CC2)nc2ccccc12 Show InChI InChI=1S/C29H32N4O2S/c34-28-26-9-4-5-10-27(26)30-29(31-28)36-22-20-33-18-16-32(17-19-33)15-6-21-35-25-13-11-24(12-14-25)23-7-2-1-3-8-23/h1-5,7-14H,6,15-22H2,(H,30,31,34)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	340	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of full length human N-terminal His-tagged PARP2 expressed in baculovirus infected Sf9 cells using histone H3.3 as substrate incubated for...				ACS Med Chem Lett 11: 862-868 (2020) Article DOI: 10.1021/acsmedchemlett.9b00654 BindingDB Entry DOI: 10.7270/Q21J9FBQ
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 2 (Homo sapiens (Human))	BDBM50540760 (CHEMBL4632484) Show SMILES O=C(CN1CCN(CCSc2nc3ccccc3c(=O)[nH]2)CC1)N1CCC2(CC1)CC(=O)c1ccccc1O2 Show InChI InChI=1S/C29H33N5O4S/c35-24-19-29(38-25-8-4-2-6-22(24)25)9-11-34(12-10-29)26(36)20-33-15-13-32(14-16-33)17-18-39-28-30-23-7-3-1-5-21(23)27(37)31-28/h1-8H,9-20H2,(H,30,31,37)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	347	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of full length human N-terminal His-tagged PARP2 expressed in baculovirus infected Sf9 cells using histone H3.3 as substrate incubated for...				ACS Med Chem Lett 11: 862-868 (2020) Article DOI: 10.1021/acsmedchemlett.9b00654 BindingDB Entry DOI: 10.7270/Q21J9FBQ
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM50540761 (CHEMBL4641894) Show SMILES O=C(OCc1ccccc1)N1CCN(CCSc2nc3ccccc3c(=O)[nH]2)CC1 Show InChI InChI=1S/C22H24N4O3S/c27-20-18-8-4-5-9-19(18)23-21(24-20)30-15-14-25-10-12-26(13-11-25)22(28)29-16-17-6-2-1-3-7-17/h1-9H,10-16H2,(H,23,24,27)	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	356	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of full length human C-terminal His-tagged PARP1 expressed in baculovirus infected Sf9 cells using chicken core histone as substrate incub...				ACS Med Chem Lett 11: 862-868 (2020) Article DOI: 10.1021/acsmedchemlett.9b00654 BindingDB Entry DOI: 10.7270/Q21J9FBQ
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 2 (Homo sapiens (Human))	BDBM50540759 (CHEMBL4648016) Show SMILES O=c1[nH]c(SCCN2CCN(CCCc3nc(no3)-c3ccccc3)CC2)nc2ccccc12 Show InChI InChI=1S/C25H28N6O2S/c32-24-20-9-4-5-10-21(20)26-25(28-24)34-18-17-31-15-13-30(14-16-31)12-6-11-22-27-23(29-33-22)19-7-2-1-3-8-19/h1-5,7-10H,6,11-18H2,(H,26,28,32)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	370	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of full length human N-terminal His-tagged PARP2 expressed in baculovirus infected Sf9 cells using histone H3.3 as substrate incubated for...				ACS Med Chem Lett 11: 862-868 (2020) Article DOI: 10.1021/acsmedchemlett.9b00654 BindingDB Entry DOI: 10.7270/Q21J9FBQ
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 (Homo sapiens (Human))	BDBM50540761 (CHEMBL4641894) Show SMILES O=C(OCc1ccccc1)N1CCN(CCSc2nc3ccccc3c(=O)[nH]2)CC1 Show InChI InChI=1S/C22H24N4O3S/c27-20-18-8-4-5-9-19(18)23-21(24-20)30-15-14-25-10-12-26(13-11-25)22(28)29-16-17-6-2-1-3-7-17/h1-9H,10-16H2,(H,23,24,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	398	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of full length human N-terminal GST-tagged TNKS1 ADP-ART catalytic domain (1001 to 1327 residues) using histone H2A as substrate incubated...				ACS Med Chem Lett 11: 862-868 (2020) Article DOI: 10.1021/acsmedchemlett.9b00654 BindingDB Entry DOI: 10.7270/Q21J9FBQ
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 2 (Homo sapiens (Human))	BDBM50540757 (CHEMBL4460557) Show SMILES O=c1[nH]c(SCCN2CCN(CC2)c2ccccn2)nc2ccccc12 Show InChI InChI=1S/C19H21N5OS/c25-18-15-5-1-2-6-16(15)21-19(22-18)26-14-13-23-9-11-24(12-10-23)17-7-3-4-8-20-17/h1-8H,9-14H2,(H,21,22,25)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	549	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of full length human N-terminal His-tagged PARP2 expressed in baculovirus infected Sf9 cells using histone H3.3 as substrate incubated for...				ACS Med Chem Lett 11: 862-868 (2020) Article DOI: 10.1021/acsmedchemlett.9b00654 BindingDB Entry DOI: 10.7270/Q21J9FBQ
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 (Homo sapiens (Human))	BDBM50540760 (CHEMBL4632484) Show SMILES O=C(CN1CCN(CCSc2nc3ccccc3c(=O)[nH]2)CC1)N1CCC2(CC1)CC(=O)c1ccccc1O2 Show InChI InChI=1S/C29H33N5O4S/c35-24-19-29(38-25-8-4-2-6-22(24)25)9-11-34(12-10-29)26(36)20-33-15-13-32(14-16-33)17-18-39-28-30-23-7-3-1-5-21(23)27(37)31-28/h1-8H,9-20H2,(H,30,31,37)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	552	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of full length human N-terminal GST-tagged TNKS1 ADP-ART catalytic domain (1001 to 1327 residues) using histone H2A as substrate incubated...				ACS Med Chem Lett 11: 862-868 (2020) Article DOI: 10.1021/acsmedchemlett.9b00654 BindingDB Entry DOI: 10.7270/Q21J9FBQ
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-2 (Homo sapiens (Human))	BDBM50540758 (CHEMBL4642139) Show SMILES O=c1[nH]c(SCCN2CCN(CCCOc3ccc(cc3)-c3ccccc3)CC2)nc2ccccc12 Show InChI InChI=1S/C29H32N4O2S/c34-28-26-9-4-5-10-27(26)30-29(31-28)36-22-20-33-18-16-32(17-19-33)15-6-21-35-25-13-11-24(12-14-25)23-7-2-1-3-8-23/h1-5,7-14H,6,15-22H2,(H,30,31,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	588	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of full length human N-terminal GST-tagged TNKS2 ADP-ART catalytic domain (1001 to 1327 residues) using histone H2A as substrate incubated...				ACS Med Chem Lett 11: 862-868 (2020) Article DOI: 10.1021/acsmedchemlett.9b00654 BindingDB Entry DOI: 10.7270/Q21J9FBQ
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 (Homo sapiens (Human))	BDBM50540758 (CHEMBL4642139) Show SMILES O=c1[nH]c(SCCN2CCN(CCCOc3ccc(cc3)-c3ccccc3)CC2)nc2ccccc12 Show InChI InChI=1S/C29H32N4O2S/c34-28-26-9-4-5-10-27(26)30-29(31-28)36-22-20-33-18-16-32(17-19-33)15-6-21-35-25-13-11-24(12-14-25)23-7-2-1-3-8-23/h1-5,7-14H,6,15-22H2,(H,30,31,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	673	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of full length human N-terminal GST-tagged TNKS1 ADP-ART catalytic domain (1001 to 1327 residues) using histone H2A as substrate incubated...				ACS Med Chem Lett 11: 862-868 (2020) Article DOI: 10.1021/acsmedchemlett.9b00654 BindingDB Entry DOI: 10.7270/Q21J9FBQ
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 2 (Homo sapiens (Human))	BDBM50540761 (CHEMBL4641894) Show SMILES O=C(OCc1ccccc1)N1CCN(CCSc2nc3ccccc3c(=O)[nH]2)CC1 Show InChI InChI=1S/C22H24N4O3S/c27-20-18-8-4-5-9-19(18)23-21(24-20)30-15-14-25-10-12-26(13-11-25)22(28)29-16-17-6-2-1-3-7-17/h1-9H,10-16H2,(H,23,24,27)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	963	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of full length human N-terminal His-tagged PARP2 expressed in baculovirus infected Sf9 cells using histone H3.3 as substrate incubated for...				ACS Med Chem Lett 11: 862-868 (2020) Article DOI: 10.1021/acsmedchemlett.9b00654 BindingDB Entry DOI: 10.7270/Q21J9FBQ
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM50540760 (CHEMBL4632484) Show SMILES O=C(CN1CCN(CCSc2nc3ccccc3c(=O)[nH]2)CC1)N1CCC2(CC1)CC(=O)c1ccccc1O2 Show InChI InChI=1S/C29H33N5O4S/c35-24-19-29(38-25-8-4-2-6-22(24)25)9-11-34(12-10-29)26(36)20-33-15-13-32(14-16-33)17-18-39-28-30-23-7-3-1-5-21(23)27(37)31-28/h1-8H,9-20H2,(H,30,31,37)	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.28E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of full length human C-terminal His-tagged PARP1 expressed in baculovirus infected Sf9 cells using chicken core histone as substrate incub...				ACS Med Chem Lett 11: 862-868 (2020) Article DOI: 10.1021/acsmedchemlett.9b00654 BindingDB Entry DOI: 10.7270/Q21J9FBQ
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM50540759 (CHEMBL4648016) Show SMILES O=c1[nH]c(SCCN2CCN(CCCc3nc(no3)-c3ccccc3)CC2)nc2ccccc12 Show InChI InChI=1S/C25H28N6O2S/c32-24-20-9-4-5-10-21(20)26-25(28-24)34-18-17-31-15-13-30(14-16-31)12-6-11-22-27-23(29-33-22)19-7-2-1-3-8-19/h1-5,7-10H,6,11-18H2,(H,26,28,32)	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.48E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of full length human C-terminal His-tagged PARP1 expressed in baculovirus infected Sf9 cells using chicken core histone as substrate incub...				ACS Med Chem Lett 11: 862-868 (2020) Article DOI: 10.1021/acsmedchemlett.9b00654 BindingDB Entry DOI: 10.7270/Q21J9FBQ
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM50540758 (CHEMBL4642139) Show SMILES O=c1[nH]c(SCCN2CCN(CCCOc3ccc(cc3)-c3ccccc3)CC2)nc2ccccc12 Show InChI InChI=1S/C29H32N4O2S/c34-28-26-9-4-5-10-27(26)30-29(31-28)36-22-20-33-18-16-32(17-19-33)15-6-21-35-25-13-11-24(12-14-25)23-7-2-1-3-8-23/h1-5,7-14H,6,15-22H2,(H,30,31,34)	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.04E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of full length human C-terminal His-tagged PARP1 expressed in baculovirus infected Sf9 cells using chicken core histone as substrate incub...				ACS Med Chem Lett 11: 862-868 (2020) Article DOI: 10.1021/acsmedchemlett.9b00654 BindingDB Entry DOI: 10.7270/Q21J9FBQ
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 2 (Homo sapiens (Human))	BDBM50540763 (CHEMBL4641161) Show SMILES O=C(CCSc1nc2ccccc2c(=O)[nH]1)N1CCC2(CC1)NC(=O)c1cc3ccccc3cc1N2 Show InChI InChI=1S/C27H25N5O3S/c33-23(9-14-36-26-28-21-8-4-3-7-19(21)24(34)29-26)32-12-10-27(11-13-32)30-22-16-18-6-2-1-5-17(18)15-20(22)25(35)31-27/h1-8,15-16,30H,9-14H2,(H,31,35)(H,28,29,34)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.32E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Naples Curated by ChEMBL					Assay Description Inhibition of full length human N-terminal His-tagged PARP2 expressed in baculovirus infected Sf9 cells using histone H3.3 as substrate incubated for...				ACS Med Chem Lett 11: 862-868 (2020) Article DOI: 10.1021/acsmedchemlett.9b00654 BindingDB Entry DOI: 10.7270/Q21J9FBQ
					More data for this Ligand-Target Pair