Compile Data Set for Download or QSAR

Found 18 hits Enz. Inhib. hit(s) with all data for entry = 7403   

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-1 [1068-1325] (Homo sapiens (Human))	BDBM192902 (US9193689, IQ-034) Show SMILES CN(C)Cc1ccc(cc1)-c1cc2c(C)cccc2c(=O)[nH]1 Show InChI InChI=1S/C19H20N2O/c1-13-5-4-6-16-17(13)11-18(20-19(16)22)15-9-7-14(8-10-15)12-21(2)3/h4-11H,12H2,1-3H3,(H,20,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (THE) US Patent					Assay Description Tankyrase activity was assayed using a 96-well format HT Universal Chemiluminescent PARP Assay Kit (Trevigen, Inc, cat. no. 4676-096-K) according to ...				US Patent US9193689 (2015) BindingDB Entry DOI: 10.7270/Q29S1PTR
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 [1068-1325] (Homo sapiens (Human))	BDBM192909 (US9193689, IQ-222) Show SMILES CN1CCN(CC1)C(=O)c1ccc(cn1)-c1cc2c(C)cc(F)cc2c(=O)[nH]1 Show InChI InChI=1S/C21H21FN4O2/c1-13-9-15(22)10-17-16(13)11-19(24-20(17)27)14-3-4-18(23-12-14)21(28)26-7-5-25(2)6-8-26/h3-4,9-12H,5-8H2,1-2H3,(H,24,27)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (THE) US Patent					Assay Description Tankyrase activity was assayed using a 96-well format HT Universal Chemiluminescent PARP Assay Kit (Trevigen, Inc, cat. no. 4676-096-K) according to ...				US Patent US9193689 (2015) BindingDB Entry DOI: 10.7270/Q29S1PTR
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 [1068-1325] (Homo sapiens (Human))	BDBM192904 (US9193689, IQ-130) Show SMILES CN(C)CCOc1ccc(cc1)-c1cc2c(C)cccc2c(=O)[nH]1 Show InChI InChI=1S/C20H22N2O2/c1-14-5-4-6-17-18(14)13-19(21-20(17)23)15-7-9-16(10-8-15)24-12-11-22(2)3/h4-10,13H,11-12H2,1-3H3,(H,21,23)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (THE) US Patent					Assay Description Tankyrase activity was assayed using a 96-well format HT Universal Chemiluminescent PARP Assay Kit (Trevigen, Inc, cat. no. 4676-096-K) according to ...				US Patent US9193689 (2015) BindingDB Entry DOI: 10.7270/Q29S1PTR
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 [1068-1325] (Homo sapiens (Human))	BDBM192905 (US9193689, REF-5) Show SMILES CN(C)CCOc1ccc(cc1)-c1cc2ccccc2c(=O)[nH]1 Show InChI InChI=1S/C19H20N2O2/c1-21(2)11-12-23-16-9-7-14(8-10-16)18-13-15-5-3-4-6-17(15)19(22)20-18/h3-10,13H,11-12H2,1-2H3,(H,20,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (THE) US Patent					Assay Description Tankyrase activity was assayed using a 96-well format HT Universal Chemiluminescent PARP Assay Kit (Trevigen, Inc, cat. no. 4676-096-K) according to ...				US Patent US9193689 (2015) BindingDB Entry DOI: 10.7270/Q29S1PTR
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 [1068-1325] (Homo sapiens (Human))	BDBM192895 (US9193689, IQ-025) Show SMILES CN1CCN(CC1)c1ncc(cn1)-c1cc2c(C)cccc2c(=O)[nH]1 Show InChI InChI=1S/C19H21N5O/c1-13-4-3-5-15-16(13)10-17(22-18(15)25)14-11-20-19(21-12-14)24-8-6-23(2)7-9-24/h3-5,10-12H,6-9H2,1-2H3,(H,22,25)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (THE) US Patent					Assay Description Tankyrase activity was assayed using a 96-well format HT Universal Chemiluminescent PARP Assay Kit (Trevigen, Inc, cat. no. 4676-096-K) according to ...				US Patent US9193689 (2015) BindingDB Entry DOI: 10.7270/Q29S1PTR
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 [1068-1325] (Homo sapiens (Human))	BDBM192903 (US9193689, REF-4) Show SMILES CN(C)Cc1ccc(cc1)-c1cc2ccccc2c(=O)[nH]1 Show InChI InChI=1S/C18H18N2O/c1-20(2)12-13-7-9-14(10-8-13)17-11-15-5-3-4-6-16(15)18(21)19-17/h3-11H,12H2,1-2H3,(H,19,21)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (THE) US Patent					Assay Description Tankyrase activity was assayed using a 96-well format HT Universal Chemiluminescent PARP Assay Kit (Trevigen, Inc, cat. no. 4676-096-K) according to ...				US Patent US9193689 (2015) BindingDB Entry DOI: 10.7270/Q29S1PTR
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 [1068-1325] (Homo sapiens (Human))	BDBM192899 (US9193689, IQ-003) Show SMILES CN1CCN(CC1)c1ccc(cn1)-c1cc2c(C)cccc2c(=O)[nH]1 Show InChI InChI=1S/C20H22N4O/c1-14-4-3-5-16-17(14)12-18(22-20(16)25)15-6-7-19(21-13-15)24-10-8-23(2)9-11-24/h3-7,12-13H,8-11H2,1-2H3,(H,22,25)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (THE) US Patent					Assay Description Tankyrase activity was assayed using a 96-well format HT Universal Chemiluminescent PARP Assay Kit (Trevigen, Inc, cat. no. 4676-096-K) according to ...				US Patent US9193689 (2015) BindingDB Entry DOI: 10.7270/Q29S1PTR
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 [1068-1325] (Homo sapiens (Human))	BDBM192901 (US9193689, REF-3) Show SMILES CN1CCN(CC1)c1ccc(cn1)-c1cc2ccccc2c(=O)[nH]1 Show InChI InChI=1S/C19H20N4O/c1-22-8-10-23(11-9-22)18-7-6-15(13-20-18)17-12-14-4-2-3-5-16(14)19(24)21-17/h2-7,12-13H,8-11H2,1H3,(H,21,24)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	24	n/a	n/a	n/a	n/a	n/a	n/a
INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (THE) US Patent					Assay Description Tankyrase activity was assayed using a 96-well format HT Universal Chemiluminescent PARP Assay Kit (Trevigen, Inc, cat. no. 4676-096-K) according to ...				US Patent US9193689 (2015) BindingDB Entry DOI: 10.7270/Q29S1PTR
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 [1068-1325] (Homo sapiens (Human))	BDBM192907 (US9193689, REF-6) Show SMILES Oc1cccc2c1cc([nH]c2=O)-c1cnc(nc1)N1CCN(CC1)C(=O)C1CC1 Show InChI InChI=1S/C21H21N5O3/c27-18-3-1-2-15-16(18)10-17(24-19(15)28)14-11-22-21(23-12-14)26-8-6-25(7-9-26)20(29)13-4-5-13/h1-3,10-13,27H,4-9H2,(H,24,28)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	24	n/a	n/a	n/a	n/a	n/a	n/a
INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (THE) US Patent					Assay Description Tankyrase activity was assayed using a 96-well format HT Universal Chemiluminescent PARP Assay Kit (Trevigen, Inc, cat. no. 4676-096-K) according to ...				US Patent US9193689 (2015) BindingDB Entry DOI: 10.7270/Q29S1PTR
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 [1068-1325] (Homo sapiens (Human))	BDBM192908 (US9193689, IQ-220) Show SMILES CN1CCN(CC1)C(=O)c1ccc(cn1)-c1cc2c(C)cccc2c(=O)[nH]1 Show InChI InChI=1S/C21H22N4O2/c1-14-4-3-5-16-17(14)12-19(23-20(16)26)15-6-7-18(22-13-15)21(27)25-10-8-24(2)9-11-25/h3-7,12-13H,8-11H2,1-2H3,(H,23,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	26	n/a	n/a	n/a	n/a	n/a	n/a
INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (THE) US Patent					Assay Description Tankyrase activity was assayed using a 96-well format HT Universal Chemiluminescent PARP Assay Kit (Trevigen, Inc, cat. no. 4676-096-K) according to ...				US Patent US9193689 (2015) BindingDB Entry DOI: 10.7270/Q29S1PTR
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 [1068-1325] (Homo sapiens (Human))	BDBM192897 (US9193689, IQ-080) Show SMILES CN1CCN(Cc2ccc(cc2)-c2cc3c(C)cc(F)cc3c(=O)[nH]2)CC1 Show InChI InChI=1S/C22H24FN3O/c1-15-11-18(23)12-20-19(15)13-21(24-22(20)27)17-5-3-16(4-6-17)14-26-9-7-25(2)8-10-26/h3-6,11-13H,7-10,14H2,1-2H3,(H,24,27)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	29	n/a	n/a	n/a	n/a	n/a	n/a
INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (THE) US Patent					Assay Description Tankyrase activity was assayed using a 96-well format HT Universal Chemiluminescent PARP Assay Kit (Trevigen, Inc, cat. no. 4676-096-K) according to ...				US Patent US9193689 (2015) BindingDB Entry DOI: 10.7270/Q29S1PTR
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 [1068-1325] (Homo sapiens (Human))	BDBM192896 (US9193689, REF-1) Show SMILES CN1CCN(CC1)c1ncc(cn1)-c1cc2ccccc2c(=O)[nH]1 Show InChI InChI=1S/C18H19N5O/c1-22-6-8-23(9-7-22)18-19-11-14(12-20-18)16-10-13-4-2-3-5-15(13)17(24)21-16/h2-5,10-12H,6-9H2,1H3,(H,21,24)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	33	n/a	n/a	n/a	n/a	n/a	n/a
INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (THE) US Patent					Assay Description Tankyrase activity was assayed using a 96-well format HT Universal Chemiluminescent PARP Assay Kit (Trevigen, Inc, cat. no. 4676-096-K) according to ...				US Patent US9193689 (2015) BindingDB Entry DOI: 10.7270/Q29S1PTR
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 [1068-1325] (Homo sapiens (Human))	BDBM192900 (US9193689, IQ-002) Show SMILES CN1CCN(CC1)c1ccc(cn1)-c1cc2c(Cl)cccc2c(=O)[nH]1 Show InChI InChI=1S/C19H19ClN4O/c1-23-7-9-24(10-8-23)18-6-5-13(12-21-18)17-11-15-14(19(25)22-17)3-2-4-16(15)20/h2-6,11-12H,7-10H2,1H3,(H,22,25)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	39	n/a	n/a	n/a	n/a	n/a	n/a
INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (THE) US Patent					Assay Description Tankyrase activity was assayed using a 96-well format HT Universal Chemiluminescent PARP Assay Kit (Trevigen, Inc, cat. no. 4676-096-K) according to ...				US Patent US9193689 (2015) BindingDB Entry DOI: 10.7270/Q29S1PTR
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 [1068-1325] (Homo sapiens (Human))	BDBM192912 (US9193689, REF-8) Show SMILES COc1ccc(nc1)-c1cc2c(C)cccc2c(=O)[nH]1 Show InChI InChI=1S/C16H14N2O2/c1-10-4-3-5-12-13(10)8-15(18-16(12)19)14-7-6-11(20-2)9-17-14/h3-9H,1-2H3,(H,18,19)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	39	n/a	n/a	n/a	n/a	n/a	n/a
INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (THE) US Patent					Assay Description Tankyrase activity was assayed using a 96-well format HT Universal Chemiluminescent PARP Assay Kit (Trevigen, Inc, cat. no. 4676-096-K) according to ...				US Patent US9193689 (2015) BindingDB Entry DOI: 10.7270/Q29S1PTR
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 [1068-1325] (Homo sapiens (Human))	BDBM192910 (US9193689, REF-7) Show SMILES CN1CCN(CC1)C(=O)c1ccc(cn1)-c1cc2c(O)cccc2c(=O)[nH]1 Show InChI InChI=1S/C20H20N4O3/c1-23-7-9-24(10-8-23)20(27)16-6-5-13(12-21-16)17-11-15-14(19(26)22-17)3-2-4-18(15)25/h2-6,11-12,25H,7-10H2,1H3,(H,22,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	42	n/a	n/a	n/a	n/a	n/a	n/a
INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (THE) US Patent					Assay Description Tankyrase activity was assayed using a 96-well format HT Universal Chemiluminescent PARP Assay Kit (Trevigen, Inc, cat. no. 4676-096-K) according to ...				US Patent US9193689 (2015) BindingDB Entry DOI: 10.7270/Q29S1PTR
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 [1068-1325] (Homo sapiens (Human))	BDBM192898 (US9193689, REF-2) Show SMILES CN1CCN(Cc2ccc(cc2)-c2cc3ccc(F)cc3c(=O)[nH]2)CC1 Show InChI InChI=1S/C21H22FN3O/c1-24-8-10-25(11-9-24)14-15-2-4-16(5-3-15)20-12-17-6-7-18(22)13-19(17)21(26)23-20/h2-7,12-13H,8-11,14H2,1H3,(H,23,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	48	n/a	n/a	n/a	n/a	n/a	n/a
INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (THE) US Patent					Assay Description Tankyrase activity was assayed using a 96-well format HT Universal Chemiluminescent PARP Assay Kit (Trevigen, Inc, cat. no. 4676-096-K) according to ...				US Patent US9193689 (2015) BindingDB Entry DOI: 10.7270/Q29S1PTR
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 [1068-1325] (Homo sapiens (Human))	BDBM192906 (US9193689, IQ-157) Show SMILES Cc1cccc2c1cc([nH]c2=O)-c1cnc(nc1)N1CCN(CC1)C(=O)C1CC1 Show InChI InChI=1S/C22H23N5O2/c1-14-3-2-4-17-18(14)11-19(25-20(17)28)16-12-23-22(24-13-16)27-9-7-26(8-10-27)21(29)15-5-6-15/h2-4,11-13,15H,5-10H2,1H3,(H,25,28)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	51	n/a	n/a	n/a	n/a	n/a	n/a
INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (THE) US Patent					Assay Description Tankyrase activity was assayed using a 96-well format HT Universal Chemiluminescent PARP Assay Kit (Trevigen, Inc, cat. no. 4676-096-K) according to ...				US Patent US9193689 (2015) BindingDB Entry DOI: 10.7270/Q29S1PTR
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 [1068-1325] (Homo sapiens (Human))	BDBM192911 (US9193689, IQ-223) Show SMILES Cc1cccc2c1cc([nH]c2=O)-c1ccc(cn1)C(=O)N1CCN(CC2CC2)CC1 Show InChI InChI=1S/C24H26N4O2/c1-16-3-2-4-19-20(16)13-22(26-23(19)29)21-8-7-18(14-25-21)24(30)28-11-9-27(10-12-28)15-17-5-6-17/h2-4,7-8,13-14,17H,5-6,9-12,15H2,1H3,(H,26,29)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	76	n/a	n/a	n/a	n/a	n/a	n/a
INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (THE) US Patent					Assay Description Tankyrase activity was assayed using a 96-well format HT Universal Chemiluminescent PARP Assay Kit (Trevigen, Inc, cat. no. 4676-096-K) according to ...				US Patent US9193689 (2015) BindingDB Entry DOI: 10.7270/Q29S1PTR
					More data for this Ligand-Target Pair