Compile Data Set for Download or QSAR

Found 272 hits with Last Name = 'zhong' and Initial = 'n'   

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
Progesterone receptor (Rattus norvegicus)	BDBM50366382 (CHEMBL57078) Show SMILES C[C@]12CCC3C(CCC4=CC(=O)CC[C@H]34)C1CC[C@@]2(O)C(F)(F)F |t:8| Show InChI InChI=1S/C19H25F3O2/c1-17-8-6-14-13-5-3-12(23)10-11(13)2-4-15(14)16(17)7-9-18(17,24)19(20,21)22/h10,13-16,24H,2-9H2,1H3/t13-,14?,15?,16?,17-,18-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article	n/a	n/a	1.20	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]R5020 binding to cytosolic progesterone receptor (PRc) of rat uterus				Bioorg Med Chem Lett 5: 1899-1902 (1995) Article DOI: 10.1016/0960-894X(95)00320-S BindingDB Entry DOI: 10.7270/Q2KP82N5
					More data for this Ligand-Target Pair
Progesterone receptor (Rattus norvegicus)	BDBM18627 ((10S,11S,14S,15S,17R)-17-[4-(dimethylamino)phenyl]...) Show SMILES [H][C@@]12CC[C@@](O)(C#CC)[C@@]1(C)C[C@@H](C1=C3CCC(=O)C=C3CC[C@@]21[H])c1ccc(cc1)N(C)C |r,c:14,20| Show InChI InChI=1S/C29H35NO2/c1-5-15-29(32)16-14-26-24-12-8-20-17-22(31)11-13-23(20)27(24)25(18-28(26,29)2)19-6-9-21(10-7-19)30(3)4/h6-7,9-10,17,24-26,32H,8,11-14,16,18H2,1-4H3/t24-,25+,26-,28-,29-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article	n/a	n/a	3.5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]R5020 binding to cytosolic progesterone receptor (PRc) of rat uterus				Bioorg Med Chem Lett 5: 1899-1902 (1995) Article DOI: 10.1016/0960-894X(95)00320-S BindingDB Entry DOI: 10.7270/Q2KP82N5
					More data for this Ligand-Target Pair				3D Structure (crystal)
Progesterone receptor (Rattus norvegicus)	BDBM50366381 (CHEMBL301446) Show SMILES C[C@]12CCC3=C4CCC(=O)C=C4CCC3C1CC[C@@]2(O)C(F)(F)F |c:4,10| Show InChI InChI=1S/C19H23F3O2/c1-17-8-6-14-13-5-3-12(23)10-11(13)2-4-15(14)16(17)7-9-18(17,24)19(20,21)22/h10,15-16,24H,2-9H2,1H3/t15?,16?,17-,18-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	4.5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]R5020 binding to cytosolic progesterone receptor (PRc) of rat uterus				Bioorg Med Chem Lett 5: 1899-1902 (1995) Article DOI: 10.1016/0960-894X(95)00320-S BindingDB Entry DOI: 10.7270/Q2KP82N5
					More data for this Ligand-Target Pair
Progesterone receptor (Rattus norvegicus)	BDBM50366380 (CHEMBL56509) Show SMILES C[C@]12C=CC3=C4CCC(=O)C=C4CCC3C1CC[C@@]2(O)C(F)(F)F |c:2,4,10| Show InChI InChI=1S/C19H21F3O2/c1-17-8-6-14-13-5-3-12(23)10-11(13)2-4-15(14)16(17)7-9-18(17,24)19(20,21)22/h6,8,10,15-16,24H,2-5,7,9H2,1H3/t15?,16?,17-,18-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]R5020 binding to cytosolic progesterone receptor (PRc) of rat uterus				Bioorg Med Chem Lett 5: 1899-1902 (1995) Article DOI: 10.1016/0960-894X(95)00320-S BindingDB Entry DOI: 10.7270/Q2KP82N5
					More data for this Ligand-Target Pair
Lethal(3)malignant brain tumor-like protein 3 (Homo sapiens (Human))	BDBM50440614 (CHEMBL2426364) Show SMILES O=C(N1CCC(CC1)N1CCCC1)c1ccc(C(=O)N2CCC(CC2)N2CCCC2)c(Nc2ccccc2)c1 Show InChI InChI=1S/C32H43N5O2/c38-31(36-20-12-27(13-21-36)34-16-4-5-17-34)25-10-11-29(30(24-25)33-26-8-2-1-3-9-26)32(39)37-22-14-28(15-23-37)35-18-6-7-19-35/h1-3,8-11,24,27-28,33H,4-7,12-23H2	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	24	n/a	n/a	n/a	n/a	n/a	n/a
University of North Carolina Curated by ChEMBL					Assay Description Inhibition of His-tagged L3MBTL3 (unknown origin) using H4K20Me2 as substrate incubated for 30 mins at room temperature followed by incubation under ...				Medchemcomm 4: 1501-1507 (2013) Article DOI: 10.1039/c3md00197k BindingDB Entry DOI: 10.7270/Q2BV7KKN
					More data for this Ligand-Target Pair				3D Structure (crystal)
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM50089862 (CHEMBL3577700) Show SMILES COc1ccc2C(=O)CC(CC(=O)N[C@@H](CNC(=O)c3ccccc3N3CCC(=O)NC3=O)C(N)=O)c2c1 |r| Show InChI InChI=1S/C26H27N5O7/c1-38-15-6-7-16-18(12-15)14(10-21(16)32)11-23(34)29-19(24(27)35)13-28-25(36)17-4-2-3-5-20(17)31-9-8-22(33)30-26(31)37/h2-7,12,14,19H,8-11,13H2,1H3,(H2,27,35)(H,28,36)(H,29,34)(H,30,33,37)/t14?,19-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
£Philochem AG Curated by ChEMBL					Assay Description Inhibition of full length PARP1 (unknown origin) expressed in Escherichia coli BL21 (DE3) assessed as reduction in ADP-ribosyl transferase activity u...				J Med Chem 58: 5143-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b00432 BindingDB Entry DOI: 10.7270/Q2R2134J
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM50089862 (CHEMBL3577700) Show SMILES COc1ccc2C(=O)CC(CC(=O)N[C@@H](CNC(=O)c3ccccc3N3CCC(=O)NC3=O)C(N)=O)c2c1 |r| Show InChI InChI=1S/C26H27N5O7/c1-38-15-6-7-16-18(12-15)14(10-21(16)32)11-23(34)29-19(24(27)35)13-28-25(36)17-4-2-3-5-20(17)31-9-8-22(33)30-26(31)37/h2-7,12,14,19H,8-11,13H2,1H3,(H2,27,35)(H,28,36)(H,29,34)(H,30,33,37)/t14?,19-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
£Philochem AG Curated by ChEMBL					Assay Description Inhibition of full length PARP1 (unknown origin) expressed in Escherichia coli BL21 (DE3) assessed as reduction in ADP-ribosyl transferase activity u...				J Med Chem 58: 5143-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b00432 BindingDB Entry DOI: 10.7270/Q2R2134J
					More data for this Ligand-Target Pair
Lethal(3)malignant brain tumor-like protein 3 (Homo sapiens (Human))	BDBM50496581 (CHEMBL3134130) Show SMILES Clc1cc(ccc1CCN1CCCC1)N1CCC(CC1)N1CCCC1 Show InChI InChI=1S/C21H32ClN3/c22-21-17-20(6-5-18(21)7-14-23-10-1-2-11-23)25-15-8-19(9-16-25)24-12-3-4-13-24/h5-6,17,19H,1-4,7-16H2	PDB KEGG UniProtKB/SwissProt B.MOAD 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 North Carolina Curated by ChEMBL					Assay Description Inhibition of His-tagged L3MBTL3 (unknown origin) using H4K20Me2 as substrate incubated for 30 mins at room temperature followed by incubation under ...				Medchemcomm 4: 1501-1507 (2013) Article DOI: 10.1039/c3md00197k BindingDB Entry DOI: 10.7270/Q2BV7KKN
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM50089863 (CHEMBL3577701) Show SMILES COc1ccc2C(=O)CC(CC(=O)NCCNC(=O)c3ccccc3N3CCC(=O)NC3=O)c2c1 Show InChI InChI=1S/C25H26N4O6/c1-35-16-6-7-17-19(14-16)15(12-21(17)30)13-23(32)26-9-10-27-24(33)18-4-2-3-5-20(18)29-11-8-22(31)28-25(29)34/h2-7,14-15H,8-13H2,1H3,(H,26,32)(H,27,33)(H,28,31,34)	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	41	n/a	n/a	n/a	n/a	n/a	n/a
£Philochem AG Curated by ChEMBL					Assay Description Inhibition of full length PARP1 (unknown origin) expressed in Escherichia coli BL21 (DE3) assessed as reduction in ADP-ribosyl transferase activity u...				J Med Chem 58: 5143-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b00432 BindingDB Entry DOI: 10.7270/Q2R2134J
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM50089863 (CHEMBL3577701) Show SMILES COc1ccc2C(=O)CC(CC(=O)NCCNC(=O)c3ccccc3N3CCC(=O)NC3=O)c2c1 Show InChI InChI=1S/C25H26N4O6/c1-35-16-6-7-17-19(14-16)15(12-21(17)30)13-23(32)26-9-10-27-24(33)18-4-2-3-5-20(18)29-11-8-22(31)28-25(29)34/h2-7,14-15H,8-13H2,1H3,(H,26,32)(H,27,33)(H,28,31,34)	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	41	n/a	n/a	n/a	n/a	n/a	n/a
£Philochem AG Curated by ChEMBL					Assay Description Inhibition of full length PARP1 (unknown origin) expressed in Escherichia coli BL21 (DE3) assessed as reduction in ADP-ribosyl transferase activity u...				J Med Chem 58: 5143-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b00432 BindingDB Entry DOI: 10.7270/Q2R2134J
					More data for this Ligand-Target Pair
Lethal(3)malignant brain tumor-like protein 3 (Homo sapiens (Human))	BDBM50496591 (CHEMBL3134144) Show SMILES C(Cc1ccc(cc1)N1CCC(CC1)N1CCCC1)N1CCC1 Show InChI InChI=1S/C20H31N3/c1-2-14-22(13-1)20-9-16-23(17-10-20)19-6-4-18(5-7-19)8-15-21-11-3-12-21/h4-7,20H,1-3,8-17H2	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	48	n/a	n/a	n/a	n/a	n/a	n/a
University of North Carolina Curated by ChEMBL					Assay Description Inhibition of His-tagged L3MBTL3 (unknown origin) using H4K20Me2 as substrate incubated for 30 mins at room temperature followed by incubation under ...				Medchemcomm 4: 1501-1507 (2013) Article DOI: 10.1039/c3md00197k BindingDB Entry DOI: 10.7270/Q2BV7KKN
					More data for this Ligand-Target Pair
Lethal(3)malignant brain tumor-like protein 3 (Homo sapiens (Human))	BDBM50496584 (CHEMBL3134146) Show SMILES OCC1(CO)CN(CCc2ccc(cc2)N2CCC(CC2)N2CCCC2)C1 Show InChI InChI=1S/C22H35N3O2/c26-17-22(18-27)15-23(16-22)12-7-19-3-5-20(6-4-19)25-13-8-21(9-14-25)24-10-1-2-11-24/h3-6,21,26-27H,1-2,7-18H2	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	59	n/a	n/a	n/a	n/a	n/a	n/a
University of North Carolina Curated by ChEMBL					Assay Description Inhibition of His-tagged L3MBTL3 (unknown origin) using H4K20Me2 as substrate incubated for 30 mins at room temperature followed by incubation under ...				Medchemcomm 4: 1501-1507 (2013) Article DOI: 10.1039/c3md00197k BindingDB Entry DOI: 10.7270/Q2BV7KKN
					More data for this Ligand-Target Pair
Lethal(3)malignant brain tumor-like protein 3 (Homo sapiens (Human))	BDBM50496593 (CHEMBL3134131) Show SMILES C(Cc1ccc(cc1)N1CCC(CC1)N1CCCC1)N1CCCC1 Show InChI InChI=1S/C21H33N3/c1-2-13-22(12-1)16-9-19-5-7-20(8-6-19)24-17-10-21(11-18-24)23-14-3-4-15-23/h5-8,21H,1-4,9-18H2	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	62	n/a	n/a	n/a	n/a	n/a	n/a
University of North Carolina Curated by ChEMBL					Assay Description Inhibition of His-tagged L3MBTL3 (unknown origin) using H4K20Me2 as substrate incubated for 30 mins at room temperature followed by incubation under ...				Medchemcomm 4: 1501-1507 (2013) Article DOI: 10.1039/c3md00197k BindingDB Entry DOI: 10.7270/Q2BV7KKN
					More data for this Ligand-Target Pair				3D Structure (crystal)
Lethal(3)malignant brain tumor-like protein 3 (Homo sapiens (Human))	BDBM50496596 (CHEMBL3134134) Show SMILES C(CN1CCCC1)Cc1ccc(cc1)N1CCC(CC1)N1CCCC1 Show InChI InChI=1S/C22H35N3/c1-2-14-23(13-1)15-5-6-20-7-9-21(10-8-20)25-18-11-22(12-19-25)24-16-3-4-17-24/h7-10,22H,1-6,11-19H2	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
University of North Carolina Curated by ChEMBL					Assay Description Inhibition of His-tagged L3MBTL3 (unknown origin) using H4K20Me2 as substrate incubated for 30 mins at room temperature followed by incubation under ...				Medchemcomm 4: 1501-1507 (2013) Article DOI: 10.1039/c3md00197k BindingDB Entry DOI: 10.7270/Q2BV7KKN
					More data for this Ligand-Target Pair
Lethal(3)malignant brain tumor-like protein 3 (Homo sapiens (Human))	BDBM50496589 (CHEMBL3134126) Show SMILES C(Cc1ccc(cc1)N1CCC(CC1)N1CCCC1)N1CCCCC1 Show InChI InChI=1S/C22H35N3/c1-2-13-23(14-3-1)17-10-20-6-8-21(9-7-20)25-18-11-22(12-19-25)24-15-4-5-16-24/h6-9,22H,1-5,10-19H2	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	80	n/a	n/a	n/a	n/a	n/a	n/a
University of North Carolina Curated by ChEMBL					Assay Description Inhibition of His-tagged L3MBTL3 (unknown origin) using H4K20Me2 as substrate incubated for 30 mins at room temperature followed by incubation under ...				Medchemcomm 4: 1501-1507 (2013) Article DOI: 10.1039/c3md00197k BindingDB Entry DOI: 10.7270/Q2BV7KKN
					More data for this Ligand-Target Pair
Lethal(3)malignant brain tumor-like protein 3 (Homo sapiens (Human))	BDBM50496583 (CHEMBL3134125) Show SMILES C(Cc1ccc(cc1)N1CCC(CC1)N1CCCC1)N1CCCCCC1 Show InChI InChI=1S/C23H37N3/c1-2-4-15-24(14-3-1)18-11-21-7-9-22(10-8-21)26-19-12-23(13-20-26)25-16-5-6-17-25/h7-10,23H,1-6,11-20H2	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
University of North Carolina Curated by ChEMBL					Assay Description Inhibition of His-tagged L3MBTL3 (unknown origin) using H4K20Me2 as substrate incubated for 30 mins at room temperature followed by incubation under ...				Medchemcomm 4: 1501-1507 (2013) Article DOI: 10.1039/c3md00197k BindingDB Entry DOI: 10.7270/Q2BV7KKN
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM50089867 (CHEMBL3577626) Show SMILES Clc1ccc(CCNC(=O)c2ccccc2N2CCC(=O)NC2=O)c(Cl)c1 Show InChI InChI=1S/C19H17Cl2N3O3/c20-13-6-5-12(15(21)11-13)7-9-22-18(26)14-3-1-2-4-16(14)24-10-8-17(25)23-19(24)27/h1-6,11H,7-10H2,(H,22,26)(H,23,25,27)	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	110	n/a	n/a	n/a	n/a	n/a	n/a
£Philochem AG Curated by ChEMBL					Assay Description Inhibition of full length PARP1 (unknown origin) expressed in Escherichia coli BL21 (DE3) assessed as reduction in ADP-ribosyl transferase activity u...				J Med Chem 58: 5143-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b00432 BindingDB Entry DOI: 10.7270/Q2R2134J
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM50089867 (CHEMBL3577626) Show SMILES Clc1ccc(CCNC(=O)c2ccccc2N2CCC(=O)NC2=O)c(Cl)c1 Show InChI InChI=1S/C19H17Cl2N3O3/c20-13-6-5-12(15(21)11-13)7-9-22-18(26)14-3-1-2-4-16(14)24-10-8-17(25)23-19(24)27/h1-6,11H,7-10H2,(H,22,26)(H,23,25,27)	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	110	n/a	n/a	n/a	n/a	n/a	n/a
£Philochem AG Curated by ChEMBL					Assay Description Inhibition of full length PARP1 (unknown origin) expressed in Escherichia coli BL21 (DE3) assessed as reduction in ADP-ribosyl transferase activity u...				J Med Chem 58: 5143-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b00432 BindingDB Entry DOI: 10.7270/Q2R2134J
					More data for this Ligand-Target Pair
Lethal(3)malignant brain tumor-like protein 3 (Homo sapiens (Human))	BDBM50496599 (CHEMBL3134136) Show SMILES C(N1CCCC1)c1cccc(c1)N1CCC(CC1)N1CCCC1 Show InChI InChI=1S/C20H31N3/c1-2-11-21(10-1)17-18-6-5-7-20(16-18)23-14-8-19(9-15-23)22-12-3-4-13-22/h5-7,16,19H,1-4,8-15,17H2	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
University of North Carolina Curated by ChEMBL					Assay Description Inhibition of His-tagged L3MBTL3 (unknown origin) using H4K20Me2 as substrate incubated for 30 mins at room temperature followed by incubation under ...				Medchemcomm 4: 1501-1507 (2013) Article DOI: 10.1039/c3md00197k BindingDB Entry DOI: 10.7270/Q2BV7KKN
					More data for this Ligand-Target Pair
Lethal(3)malignant brain tumor-like protein 3 (Homo sapiens (Human))	BDBM50496592 (CHEMBL3134135) Show SMILES C(Cc1cccc(c1)N1CCC(CC1)N1CCCC1)N1CCCC1 Show InChI InChI=1S/C21H33N3/c1-2-12-22(11-1)15-8-19-6-5-7-21(18-19)24-16-9-20(10-17-24)23-13-3-4-14-23/h5-7,18,20H,1-4,8-17H2	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
University of North Carolina Curated by ChEMBL					Assay Description Inhibition of His-tagged L3MBTL3 (unknown origin) using H4K20Me2 as substrate incubated for 30 mins at room temperature followed by incubation under ...				Medchemcomm 4: 1501-1507 (2013) Article DOI: 10.1039/c3md00197k BindingDB Entry DOI: 10.7270/Q2BV7KKN
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM50089864 (CHEMBL3577702) Show SMILES COc1ccc2C(=O)CC(CC(=O)N3CCN(CC3)C(=O)c3ccccc3N3CCC(=O)NC3=O)c2c1 Show InChI InChI=1S/C27H28N4O6/c1-37-18-6-7-19-21(16-18)17(14-23(19)32)15-25(34)29-10-12-30(13-11-29)26(35)20-4-2-3-5-22(20)31-9-8-24(33)28-27(31)36/h2-7,16-17H,8-15H2,1H3,(H,28,33,36)	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	195	n/a	n/a	n/a	n/a	n/a	n/a
£Philochem AG Curated by ChEMBL					Assay Description Inhibition of full length PARP1 (unknown origin) expressed in Escherichia coli BL21 (DE3) assessed as reduction in ADP-ribosyl transferase activity u...				J Med Chem 58: 5143-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b00432 BindingDB Entry DOI: 10.7270/Q2R2134J
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM50089864 (CHEMBL3577702) Show SMILES COc1ccc2C(=O)CC(CC(=O)N3CCN(CC3)C(=O)c3ccccc3N3CCC(=O)NC3=O)c2c1 Show InChI InChI=1S/C27H28N4O6/c1-37-18-6-7-19-21(16-18)17(14-23(19)32)15-25(34)29-10-12-30(13-11-29)26(35)20-4-2-3-5-22(20)31-9-8-24(33)28-27(31)36/h2-7,16-17H,8-15H2,1H3,(H,28,33,36)	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
£Philochem AG Curated by ChEMBL					Assay Description Inhibition of full length PARP1 (unknown origin) expressed in Escherichia coli BL21 (DE3) assessed as reduction in ADP-ribosyl transferase activity u...				J Med Chem 58: 5143-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b00432 BindingDB Entry DOI: 10.7270/Q2R2134J
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM50089866 (CHEMBL3577625) Show SMILES O=C(NCc1ccc(cc1)-n1cccn1)c1ccccc1N1CCC(=O)NC1=O Show InChI InChI=1S/C21H19N5O3/c27-19-10-13-25(21(29)24-19)18-5-2-1-4-17(18)20(28)22-14-15-6-8-16(9-7-15)26-12-3-11-23-26/h1-9,11-12H,10,13-14H2,(H,22,28)(H,24,27,29)	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	220	n/a	n/a	n/a	n/a	n/a	n/a
£Philochem AG Curated by ChEMBL					Assay Description Inhibition of full length PARP1 (unknown origin) expressed in Escherichia coli BL21 (DE3) assessed as reduction in ADP-ribosyl transferase activity u...				J Med Chem 58: 5143-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b00432 BindingDB Entry DOI: 10.7270/Q2R2134J
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM50089866 (CHEMBL3577625) Show SMILES O=C(NCc1ccc(cc1)-n1cccn1)c1ccccc1N1CCC(=O)NC1=O Show InChI InChI=1S/C21H19N5O3/c27-19-10-13-25(21(29)24-19)18-5-2-1-4-17(18)20(28)22-14-15-6-8-16(9-7-15)26-12-3-11-23-26/h1-9,11-12H,10,13-14H2,(H,22,28)(H,24,27,29)	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	224	n/a	n/a	n/a	n/a	n/a	n/a
£Philochem AG Curated by ChEMBL					Assay Description Inhibition of full length PARP1 (unknown origin) expressed in Escherichia coli BL21 (DE3) assessed as reduction in ADP-ribosyl transferase activity u...				J Med Chem 58: 5143-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b00432 BindingDB Entry DOI: 10.7270/Q2R2134J
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 (Homo sapiens (Human))	BDBM50089865 (CHEMBL3577624) Show SMILES O=C(NCCc1nc(no1)-c1ccccn1)c1ccccc1N1CCC(=O)NC1=O Show InChI InChI=1S/C20H18N6O4/c27-16-9-12-26(20(29)23-16)15-7-2-1-5-13(15)19(28)22-11-8-17-24-18(25-30-17)14-6-3-4-10-21-14/h1-7,10H,8-9,11-12H2,(H,22,28)(H,23,27,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	245	n/a	n/a	n/a	n/a	n/a	n/a
£Philochem AG Curated by ChEMBL					Assay Description Inhibition of hexa-histidine tagged recombinant tankyrase 1 biotinylated catalytic domain (amino acids 1106 to 1325) (unknown origin) expressed in Es...				J Med Chem 58: 5143-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b00432 BindingDB Entry DOI: 10.7270/Q2R2134J
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 (Homo sapiens (Human))	BDBM50089865 (CHEMBL3577624) Show SMILES O=C(NCCc1nc(no1)-c1ccccn1)c1ccccc1N1CCC(=O)NC1=O Show InChI InChI=1S/C20H18N6O4/c27-16-9-12-26(20(29)23-16)15-7-2-1-5-13(15)19(28)22-11-8-17-24-18(25-30-17)14-6-3-4-10-21-14/h1-7,10H,8-9,11-12H2,(H,22,28)(H,23,27,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	250	n/a	n/a	n/a	n/a	n/a	n/a
£Philochem AG Curated by ChEMBL					Assay Description Inhibition of hexa-histidine tagged recombinant tankyrase 1 biotinylated catalytic domain (amino acids 1106 to 1325) (unknown origin) expressed in Es...				J Med Chem 58: 5143-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b00432 BindingDB Entry DOI: 10.7270/Q2R2134J
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM50089865 (CHEMBL3577624) Show SMILES O=C(NCCc1nc(no1)-c1ccccn1)c1ccccc1N1CCC(=O)NC1=O Show InChI InChI=1S/C20H18N6O4/c27-16-9-12-26(20(29)23-16)15-7-2-1-5-13(15)19(28)22-11-8-17-24-18(25-30-17)14-6-3-4-10-21-14/h1-7,10H,8-9,11-12H2,(H,22,28)(H,23,27,29)	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	257	n/a	n/a	n/a	n/a	n/a	n/a
£Philochem AG Curated by ChEMBL					Assay Description Inhibition of full length PARP1 (unknown origin) expressed in Escherichia coli BL21 (DE3) assessed as reduction in ADP-ribosyl transferase activity u...				J Med Chem 58: 5143-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b00432 BindingDB Entry DOI: 10.7270/Q2R2134J
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM50089865 (CHEMBL3577624) Show SMILES O=C(NCCc1nc(no1)-c1ccccn1)c1ccccc1N1CCC(=O)NC1=O Show InChI InChI=1S/C20H18N6O4/c27-16-9-12-26(20(29)23-16)15-7-2-1-5-13(15)19(28)22-11-8-17-24-18(25-30-17)14-6-3-4-10-21-14/h1-7,10H,8-9,11-12H2,(H,22,28)(H,23,27,29)	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	260	n/a	n/a	n/a	n/a	n/a	n/a
£Philochem AG Curated by ChEMBL					Assay Description Inhibition of full length PARP1 (unknown origin) expressed in Escherichia coli BL21 (DE3) assessed as reduction in ADP-ribosyl transferase activity u...				J Med Chem 58: 5143-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b00432 BindingDB Entry DOI: 10.7270/Q2R2134J
					More data for this Ligand-Target Pair
Lethal(3)malignant brain tumor-like protein 3 (Homo sapiens (Human))	BDBM50496597 (CHEMBL3134129) Show SMILES C(Cc1ccc(cc1)N1CCC(CC1)N1CCCC1)N1CC2(COC2)C1 Show InChI InChI=1S/C22H33N3O/c1-2-11-24(10-1)21-8-13-25(14-9-21)20-5-3-19(4-6-20)7-12-23-15-22(16-23)17-26-18-22/h3-6,21H,1-2,7-18H2	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
University of North Carolina Curated by ChEMBL					Assay Description Inhibition of His-tagged L3MBTL3 (unknown origin) using H4K20Me2 as substrate incubated for 30 mins at room temperature followed by incubation under ...				Medchemcomm 4: 1501-1507 (2013) Article DOI: 10.1039/c3md00197k BindingDB Entry DOI: 10.7270/Q2BV7KKN
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 (Homo sapiens (Human))	BDBM50089864 (CHEMBL3577702) Show SMILES COc1ccc2C(=O)CC(CC(=O)N3CCN(CC3)C(=O)c3ccccc3N3CCC(=O)NC3=O)c2c1 Show InChI InChI=1S/C27H28N4O6/c1-37-18-6-7-19-21(16-18)17(14-23(19)32)15-25(34)29-10-12-30(13-11-29)26(35)20-4-2-3-5-22(20)31-9-8-24(33)28-27(31)36/h2-7,16-17H,8-15H2,1H3,(H,28,33,36)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	288	n/a	n/a	n/a	n/a	n/a	n/a
£Philochem AG Curated by ChEMBL					Assay Description Inhibition of hexa-histidine tagged recombinant tankyrase 1 biotinylated catalytic domain (amino acids 1106 to 1325) (unknown origin) expressed in Es...				J Med Chem 58: 5143-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b00432 BindingDB Entry DOI: 10.7270/Q2R2134J
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 (Homo sapiens (Human))	BDBM50089863 (CHEMBL3577701) Show SMILES COc1ccc2C(=O)CC(CC(=O)NCCNC(=O)c3ccccc3N3CCC(=O)NC3=O)c2c1 Show InChI InChI=1S/C25H26N4O6/c1-35-16-6-7-17-19(14-16)15(12-21(17)30)13-23(32)26-9-10-27-24(33)18-4-2-3-5-20(18)29-11-8-22(31)28-25(29)34/h2-7,14-15H,8-13H2,1H3,(H,26,32)(H,27,33)(H,28,31,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	288	n/a	n/a	n/a	n/a	n/a	n/a
£Philochem AG Curated by ChEMBL					Assay Description Inhibition of hexa-histidine tagged recombinant tankyrase 1 biotinylated catalytic domain (amino acids 1106 to 1325) (unknown origin) expressed in Es...				J Med Chem 58: 5143-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b00432 BindingDB Entry DOI: 10.7270/Q2R2134J
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 (Homo sapiens (Human))	BDBM50089864 (CHEMBL3577702) Show SMILES COc1ccc2C(=O)CC(CC(=O)N3CCN(CC3)C(=O)c3ccccc3N3CCC(=O)NC3=O)c2c1 Show InChI InChI=1S/C27H28N4O6/c1-37-18-6-7-19-21(16-18)17(14-23(19)32)15-25(34)29-10-12-30(13-11-29)26(35)20-4-2-3-5-22(20)31-9-8-24(33)28-27(31)36/h2-7,16-17H,8-15H2,1H3,(H,28,33,36)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	290	n/a	n/a	n/a	n/a	n/a	n/a
£Philochem AG Curated by ChEMBL					Assay Description Inhibition of hexa-histidine tagged recombinant tankyrase 1 biotinylated catalytic domain (amino acids 1106 to 1325) (unknown origin) expressed in Es...				J Med Chem 58: 5143-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b00432 BindingDB Entry DOI: 10.7270/Q2R2134J
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 (Homo sapiens (Human))	BDBM50089863 (CHEMBL3577701) Show SMILES COc1ccc2C(=O)CC(CC(=O)NCCNC(=O)c3ccccc3N3CCC(=O)NC3=O)c2c1 Show InChI InChI=1S/C25H26N4O6/c1-35-16-6-7-17-19(14-16)15(12-21(17)30)13-23(32)26-9-10-27-24(33)18-4-2-3-5-20(18)29-11-8-22(31)28-25(29)34/h2-7,14-15H,8-13H2,1H3,(H,26,32)(H,27,33)(H,28,31,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	290	n/a	n/a	n/a	n/a	n/a	n/a
£Philochem AG Curated by ChEMBL					Assay Description Inhibition of hexa-histidine tagged recombinant tankyrase 1 biotinylated catalytic domain (amino acids 1106 to 1325) (unknown origin) expressed in Es...				J Med Chem 58: 5143-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b00432 BindingDB Entry DOI: 10.7270/Q2R2134J
					More data for this Ligand-Target Pair
Lethal(3)malignant brain tumor-like protein 3 (Homo sapiens (Human))	BDBM50496598 (CHEMBL3134140) Show SMILES C1CCN(C1)C1CCN(CC1)c1ccc(cc1)N1CCC(CC1)N1CCCC1 Show InChI InChI=1S/C24H38N4/c1-2-14-25(13-1)23-9-17-27(18-10-23)21-5-7-22(8-6-21)28-19-11-24(12-20-28)26-15-3-4-16-26/h5-8,23-24H,1-4,9-20H2	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	320	n/a	n/a	n/a	n/a	n/a	n/a
University of North Carolina Curated by ChEMBL					Assay Description Inhibition of His-tagged L3MBTL3 (unknown origin) using H4K20Me2 as substrate incubated for 30 mins at room temperature followed by incubation under ...				Medchemcomm 4: 1501-1507 (2013) Article DOI: 10.1039/c3md00197k BindingDB Entry DOI: 10.7270/Q2BV7KKN
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 (Homo sapiens (Human))	BDBM50089866 (CHEMBL3577625) Show SMILES O=C(NCc1ccc(cc1)-n1cccn1)c1ccccc1N1CCC(=O)NC1=O Show InChI InChI=1S/C21H19N5O3/c27-19-10-13-25(21(29)24-19)18-5-2-1-4-17(18)20(28)22-14-15-6-8-16(9-7-15)26-12-3-11-23-26/h1-9,11-12H,10,13-14H2,(H,22,28)(H,24,27,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	330	n/a	n/a	n/a	n/a	n/a	n/a
£Philochem AG Curated by ChEMBL					Assay Description Inhibition of hexa-histidine tagged recombinant tankyrase 1 biotinylated catalytic domain (amino acids 1106 to 1325) (unknown origin) expressed in Es...				J Med Chem 58: 5143-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b00432 BindingDB Entry DOI: 10.7270/Q2R2134J
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-2 (Homo sapiens (Human))	BDBM50089864 (CHEMBL3577702) Show SMILES COc1ccc2C(=O)CC(CC(=O)N3CCN(CC3)C(=O)c3ccccc3N3CCC(=O)NC3=O)c2c1 Show InChI InChI=1S/C27H28N4O6/c1-37-18-6-7-19-21(16-18)17(14-23(19)32)15-25(34)29-10-12-30(13-11-29)26(35)20-4-2-3-5-22(20)31-9-8-24(33)28-27(31)36/h2-7,16-17H,8-15H2,1H3,(H,28,33,36)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	330	n/a	n/a	n/a	n/a	n/a	n/a
£Philochem AG Curated by ChEMBL					Assay Description Inhibition of tankyrase 2 catalytic domain (unknown origin) expressed in Escherichia coli BL21 (DE3) assessed as reduction in ADP-ribosyl transferase...				J Med Chem 58: 5143-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b00432 BindingDB Entry DOI: 10.7270/Q2R2134J
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 (Homo sapiens (Human))	BDBM50089866 (CHEMBL3577625) Show SMILES O=C(NCc1ccc(cc1)-n1cccn1)c1ccccc1N1CCC(=O)NC1=O Show InChI InChI=1S/C21H19N5O3/c27-19-10-13-25(21(29)24-19)18-5-2-1-4-17(18)20(28)22-14-15-6-8-16(9-7-15)26-12-3-11-23-26/h1-9,11-12H,10,13-14H2,(H,22,28)(H,24,27,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	331	n/a	n/a	n/a	n/a	n/a	n/a
£Philochem AG Curated by ChEMBL					Assay Description Inhibition of hexa-histidine tagged recombinant tankyrase 1 biotinylated catalytic domain (amino acids 1106 to 1325) (unknown origin) expressed in Es...				J Med Chem 58: 5143-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b00432 BindingDB Entry DOI: 10.7270/Q2R2134J
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-2 (Homo sapiens (Human))	BDBM50089864 (CHEMBL3577702) Show SMILES COc1ccc2C(=O)CC(CC(=O)N3CCN(CC3)C(=O)c3ccccc3N3CCC(=O)NC3=O)c2c1 Show InChI InChI=1S/C27H28N4O6/c1-37-18-6-7-19-21(16-18)17(14-23(19)32)15-25(34)29-10-12-30(13-11-29)26(35)20-4-2-3-5-22(20)31-9-8-24(33)28-27(31)36/h2-7,16-17H,8-15H2,1H3,(H,28,33,36)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	331	n/a	n/a	n/a	n/a	n/a	n/a
£Philochem AG Curated by ChEMBL					Assay Description Inhibition of tankyrase 2 catalytic domain (unknown origin) expressed in Escherichia coli BL21 (DE3) assessed as reduction in ADP-ribosyl transferase...				J Med Chem 58: 5143-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b00432 BindingDB Entry DOI: 10.7270/Q2R2134J
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 (Homo sapiens (Human))	BDBM50089858 (CHEMBL3577627) Show SMILES Brc1ccc(CCNC(=O)c2ccccc2N2CCC(=O)NC2=O)cc1 Show InChI InChI=1S/C19H18BrN3O3/c20-14-7-5-13(6-8-14)9-11-21-18(25)15-3-1-2-4-16(15)23-12-10-17(24)22-19(23)26/h1-8H,9-12H2,(H,21,25)(H,22,24,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	347	n/a	n/a	n/a	n/a	n/a	n/a
£Philochem AG Curated by ChEMBL					Assay Description Inhibition of hexa-histidine tagged recombinant tankyrase 1 biotinylated catalytic domain (amino acids 1106 to 1325) (unknown origin) expressed in Es...				J Med Chem 58: 5143-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b00432 BindingDB Entry DOI: 10.7270/Q2R2134J
					More data for this Ligand-Target Pair
Lethal(3)malignant brain tumor-like protein 3 (Homo sapiens (Human))	BDBM50496579 (CHEMBL3134133) Show SMILES C(N1CCCC1)c1ccc(cc1)N1CCC(CC1)N1CCCC1 Show InChI InChI=1S/C20H31N3/c1-2-12-21(11-1)17-18-5-7-19(8-6-18)23-15-9-20(10-16-23)22-13-3-4-14-22/h5-8,20H,1-4,9-17H2	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	350	n/a	n/a	n/a	n/a	n/a	n/a
University of North Carolina Curated by ChEMBL					Assay Description Inhibition of His-tagged L3MBTL3 (unknown origin) using H4K20Me2 as substrate incubated for 30 mins at room temperature followed by incubation under ...				Medchemcomm 4: 1501-1507 (2013) Article DOI: 10.1039/c3md00197k BindingDB Entry DOI: 10.7270/Q2BV7KKN
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 (Homo sapiens (Human))	BDBM50089858 (CHEMBL3577627) Show SMILES Brc1ccc(CCNC(=O)c2ccccc2N2CCC(=O)NC2=O)cc1 Show InChI InChI=1S/C19H18BrN3O3/c20-14-7-5-13(6-8-14)9-11-21-18(25)15-3-1-2-4-16(15)23-12-10-17(24)22-19(23)26/h1-8H,9-12H2,(H,21,25)(H,22,24,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	350	n/a	n/a	n/a	n/a	n/a	n/a
£Philochem AG Curated by ChEMBL					Assay Description Inhibition of hexa-histidine tagged recombinant tankyrase 1 biotinylated catalytic domain (amino acids 1106 to 1325) (unknown origin) expressed in Es...				J Med Chem 58: 5143-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b00432 BindingDB Entry DOI: 10.7270/Q2R2134J
					More data for this Ligand-Target Pair
Lethal(3)malignant brain tumor-like protein 3 (Homo sapiens (Human))	BDBM50496586 (CHEMBL3134142) Show SMILES N#CC1CCN(CCc2ccc(cc2)N2CCC(CC2)N2CCCC2)C1 Show InChI InChI=1S/C22H32N4/c23-17-20-8-14-24(18-20)13-7-19-3-5-21(6-4-19)26-15-9-22(10-16-26)25-11-1-2-12-25/h3-6,20,22H,1-2,7-16,18H2	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	360	n/a	n/a	n/a	n/a	n/a	n/a
University of North Carolina Curated by ChEMBL					Assay Description Inhibition of His-tagged L3MBTL3 (unknown origin) using H4K20Me2 as substrate incubated for 30 mins at room temperature followed by incubation under ...				Medchemcomm 4: 1501-1507 (2013) Article DOI: 10.1039/c3md00197k BindingDB Entry DOI: 10.7270/Q2BV7KKN
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 (Homo sapiens (Human))	BDBM50089862 (CHEMBL3577700) Show SMILES COc1ccc2C(=O)CC(CC(=O)N[C@@H](CNC(=O)c3ccccc3N3CCC(=O)NC3=O)C(N)=O)c2c1 |r| Show InChI InChI=1S/C26H27N5O7/c1-38-15-6-7-16-18(12-15)14(10-21(16)32)11-23(34)29-19(24(27)35)13-28-25(36)17-4-2-3-5-20(17)31-9-8-22(33)30-26(31)37/h2-7,12,14,19H,8-11,13H2,1H3,(H2,27,35)(H,28,36)(H,29,34)(H,30,33,37)/t14?,19-/m0/s1	PDB UniProtKB/SwissProt 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
£Philochem AG Curated by ChEMBL					Assay Description Inhibition of hexa-histidine tagged recombinant tankyrase 1 biotinylated catalytic domain (amino acids 1106 to 1325) (unknown origin) expressed in Es...				J Med Chem 58: 5143-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b00432 BindingDB Entry DOI: 10.7270/Q2R2134J
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 (Homo sapiens (Human))	BDBM50089862 (CHEMBL3577700) Show SMILES COc1ccc2C(=O)CC(CC(=O)N[C@@H](CNC(=O)c3ccccc3N3CCC(=O)NC3=O)C(N)=O)c2c1 |r| Show InChI InChI=1S/C26H27N5O7/c1-38-15-6-7-16-18(12-15)14(10-21(16)32)11-23(34)29-19(24(27)35)13-28-25(36)17-4-2-3-5-20(17)31-9-8-22(33)30-26(31)37/h2-7,12,14,19H,8-11,13H2,1H3,(H2,27,35)(H,28,36)(H,29,34)(H,30,33,37)/t14?,19-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	372	n/a	n/a	n/a	n/a	n/a	n/a
£Philochem AG Curated by ChEMBL					Assay Description Inhibition of hexa-histidine tagged recombinant tankyrase 1 biotinylated catalytic domain (amino acids 1106 to 1325) (unknown origin) expressed in Es...				J Med Chem 58: 5143-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b00432 BindingDB Entry DOI: 10.7270/Q2R2134J
					More data for this Ligand-Target Pair
Lethal(3)malignant brain tumor-like protein 3 (Homo sapiens (Human))	BDBM50496585 (CHEMBL3134143) Show SMILES O=C1CCN(CCc2ccc(cc2)N2CCC(CC2)N2CCCC2)C1 Show InChI InChI=1S/C21H31N3O/c25-21-10-14-22(17-21)13-7-18-3-5-19(6-4-18)24-15-8-20(9-16-24)23-11-1-2-12-23/h3-6,20H,1-2,7-17H2	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	390	n/a	n/a	n/a	n/a	n/a	n/a
University of North Carolina Curated by ChEMBL					Assay Description Inhibition of His-tagged L3MBTL3 (unknown origin) using H4K20Me2 as substrate incubated for 30 mins at room temperature followed by incubation under ...				Medchemcomm 4: 1501-1507 (2013) Article DOI: 10.1039/c3md00197k BindingDB Entry DOI: 10.7270/Q2BV7KKN
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-2 (Homo sapiens (Human))	BDBM50089862 (CHEMBL3577700) Show SMILES COc1ccc2C(=O)CC(CC(=O)N[C@@H](CNC(=O)c3ccccc3N3CCC(=O)NC3=O)C(N)=O)c2c1 |r| Show InChI InChI=1S/C26H27N5O7/c1-38-15-6-7-16-18(12-15)14(10-21(16)32)11-23(34)29-19(24(27)35)13-28-25(36)17-4-2-3-5-20(17)31-9-8-22(33)30-26(31)37/h2-7,12,14,19H,8-11,13H2,1H3,(H2,27,35)(H,28,36)(H,29,34)(H,30,33,37)/t14?,19-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	468	n/a	n/a	n/a	n/a	n/a	n/a
£Philochem AG Curated by ChEMBL					Assay Description Inhibition of tankyrase 2 catalytic domain (unknown origin) expressed in Escherichia coli BL21 (DE3) assessed as reduction in ADP-ribosyl transferase...				J Med Chem 58: 5143-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b00432 BindingDB Entry DOI: 10.7270/Q2R2134J
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-2 (Homo sapiens (Human))	BDBM50089862 (CHEMBL3577700) Show SMILES COc1ccc2C(=O)CC(CC(=O)N[C@@H](CNC(=O)c3ccccc3N3CCC(=O)NC3=O)C(N)=O)c2c1 |r| Show InChI InChI=1S/C26H27N5O7/c1-38-15-6-7-16-18(12-15)14(10-21(16)32)11-23(34)29-19(24(27)35)13-28-25(36)17-4-2-3-5-20(17)31-9-8-22(33)30-26(31)37/h2-7,12,14,19H,8-11,13H2,1H3,(H2,27,35)(H,28,36)(H,29,34)(H,30,33,37)/t14?,19-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	470	n/a	n/a	n/a	n/a	n/a	n/a
£Philochem AG Curated by ChEMBL					Assay Description Inhibition of tankyrase 2 catalytic domain (unknown origin) expressed in Escherichia coli BL21 (DE3) assessed as reduction in ADP-ribosyl transferase...				J Med Chem 58: 5143-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b00432 BindingDB Entry DOI: 10.7270/Q2R2134J
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 (Homo sapiens (Human))	BDBM50089859 (CHEMBL3577628) Show SMILES Clc1ccc(CCNC(=O)c2ccccc2N2CCC(=O)NC2=O)cc1 Show InChI InChI=1S/C19H18ClN3O3/c20-14-7-5-13(6-8-14)9-11-21-18(25)15-3-1-2-4-16(15)23-12-10-17(24)22-19(23)26/h1-8H,9-12H2,(H,21,25)(H,22,24,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	570	n/a	n/a	n/a	n/a	n/a	n/a
£Philochem AG Curated by ChEMBL					Assay Description Inhibition of hexa-histidine tagged recombinant tankyrase 1 biotinylated catalytic domain (amino acids 1106 to 1325) (unknown origin) expressed in Es...				J Med Chem 58: 5143-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b00432 BindingDB Entry DOI: 10.7270/Q2R2134J
					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-1 (Homo sapiens (Human))	BDBM50089859 (CHEMBL3577628) Show SMILES Clc1ccc(CCNC(=O)c2ccccc2N2CCC(=O)NC2=O)cc1 Show InChI InChI=1S/C19H18ClN3O3/c20-14-7-5-13(6-8-14)9-11-21-18(25)15-3-1-2-4-16(15)23-12-10-17(24)22-19(23)26/h1-8H,9-12H2,(H,21,25)(H,22,24,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	575	n/a	n/a	n/a	n/a	n/a	n/a
£Philochem AG Curated by ChEMBL					Assay Description Inhibition of hexa-histidine tagged recombinant tankyrase 1 biotinylated catalytic domain (amino acids 1106 to 1325) (unknown origin) expressed in Es...				J Med Chem 58: 5143-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b00432 BindingDB Entry DOI: 10.7270/Q2R2134J
					More data for this Ligand-Target Pair
Lethal(3)malignant brain tumor-like protein 3 (Homo sapiens (Human))	BDBM50496580 (CHEMBL3134132) Show SMILES C(Cc1ccc(cc1)N1CCC(CC1)N1CCCCC1)N1CCCC1 Show InChI InChI=1S/C22H35N3/c1-2-15-24(16-3-1)22-11-18-25(19-12-22)21-8-6-20(7-9-21)10-17-23-13-4-5-14-23/h6-9,22H,1-5,10-19H2	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	580	n/a	n/a	n/a	n/a	n/a	n/a
University of North Carolina Curated by ChEMBL					Assay Description Inhibition of His-tagged L3MBTL3 (unknown origin) using H4K20Me2 as substrate incubated for 30 mins at room temperature followed by incubation under ...				Medchemcomm 4: 1501-1507 (2013) Article DOI: 10.1039/c3md00197k BindingDB Entry DOI: 10.7270/Q2BV7KKN
					More data for this Ligand-Target Pair

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