Compile Data Set for Download or QSAR

Found 92 hits with Last Name = 'carr' and Initial = 'tj'   

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
Cathepsin K (Homo sapiens (Human))	BDBM50066650 (1,3-BIS[[N-[(PHENYLMETHOXY)CARBONYL]-L-LEUCYL]AMIN...) Show SMILES CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)NCC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1 Show InChI InChI=1S/C31H42N4O7/c1-21(2)15-26(34-30(39)41-19-23-11-7-5-8-12-23)28(37)32-17-25(36)18-33-29(38)27(16-22(3)4)35-31(40)42-20-24-13-9-6-10-14-24/h5-14,21-22,26-27H,15-20H2,1-4H3,(H,32,37)(H,33,38)(H,34,39)(H,35,40)/t26-,27-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	22	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory activity measured against cathepsin K.				J Med Chem 41: 4567-76 (1998) Article DOI: 10.1021/jm980249f BindingDB Entry DOI: 10.7270/Q26974TN
					More data for this Ligand-Target Pair				3D Structure (docked)
Papain (Carica papaya)	BDBM50066650 (1,3-BIS[[N-[(PHENYLMETHOXY)CARBONYL]-L-LEUCYL]AMIN...) Show SMILES CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)NCC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1 Show InChI InChI=1S/C31H42N4O7/c1-21(2)15-26(34-30(39)41-19-23-11-7-5-8-12-23)28(37)32-17-25(36)18-33-29(38)27(16-22(3)4)35-31(40)42-20-24-13-9-6-10-14-24/h5-14,21-22,26-27H,15-20H2,1-4H3,(H,32,37)(H,33,38)(H,34,39)(H,35,40)/t26-,27-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory activity measured against papain.				J Med Chem 41: 4567-76 (1998) Article DOI: 10.1021/jm980249f BindingDB Entry DOI: 10.7270/Q26974TN
					More data for this Ligand-Target Pair
RNA-directed RNA polymerase (Hepatitis C virus)	BDBM50162519 ((2S,4S,5R)-2-ISOBUTYL-5-(2-THIENYL)-1-[4-(TRIFLUOR...) Show SMILES CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccc(cc1)C(F)(F)F)c1cccs1)C(O)=O)C(O)=O Show InChI InChI=1S/C22H22F3NO5S/c1-12(2)10-21(20(30)31)11-15(19(28)29)17(16-4-3-9-32-16)26(21)18(27)13-5-7-14(8-6-13)22(23,24)25/h3-9,12,15,17H,10-11H2,1-2H3,(H,28,29)(H,30,31)/t15-,17+,21-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory concentration against Hepatitis C virus RNA dependent RNA polymerase Nonstructural protein 5B				Bioorg Med Chem Lett 15: 1553-6 (2005) Article DOI: 10.1016/j.bmcl.2005.01.076 BindingDB Entry DOI: 10.7270/Q269732C
					More data for this Ligand-Target Pair
RNA-directed RNA polymerase (Hepatitis C virus)	BDBM50162527 ((2S,4S,5R)-2-Isobutyl-5-thiazol-2-yl-1-(4-trifluor...) Show SMILES CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccc(cc1)C(F)(F)F)c1nccs1)C(O)=O)C(O)=O Show InChI InChI=1S/C21H21F3N2O5S/c1-11(2)9-20(19(30)31)10-14(18(28)29)15(16-25-7-8-32-16)26(20)17(27)12-3-5-13(6-4-12)21(22,23)24/h3-8,11,14-15H,9-10H2,1-2H3,(H,28,29)(H,30,31)/t14-,15+,20-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory concentration against Hepatitis C virus RNA dependent RNA polymerase Nonstructural protein 5B				Bioorg Med Chem Lett 15: 1553-6 (2005) Article DOI: 10.1016/j.bmcl.2005.01.076 BindingDB Entry DOI: 10.7270/Q269732C
					More data for this Ligand-Target Pair
RNA-directed RNA polymerase (Hepatitis C virus)	BDBM50162518 ((2S,4S,5S)-2-Isobutyl-5-isopropyl-1-(4-trifluorome...) Show SMILES CC(C)C[C@]1(C[C@@H]([C@H](C(C)C)N1C(=O)c1ccc(cc1)C(F)(F)F)C(O)=O)C(O)=O Show InChI InChI=1S/C21H26F3NO5/c1-11(2)9-20(19(29)30)10-15(18(27)28)16(12(3)4)25(20)17(26)13-5-7-14(8-6-13)21(22,23)24/h5-8,11-12,15-16H,9-10H2,1-4H3,(H,27,28)(H,29,30)/t15-,16-,20-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory concentration against Hepatitis C virus RNA dependent RNA polymerase Nonstructural protein 5B				Bioorg Med Chem Lett 15: 1553-6 (2005) Article DOI: 10.1016/j.bmcl.2005.01.076 BindingDB Entry DOI: 10.7270/Q269732C
					More data for this Ligand-Target Pair
RNA-directed RNA polymerase (Hepatitis C virus)	BDBM50162531 ((2S,4S,5R)-1-(3,4-Dichloro-benzoyl)-2-isobutyl-5-t...) Show SMILES CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccc(Cl)c(Cl)c1)c1cccs1)C(O)=O)C(O)=O Show InChI InChI=1S/C21H21Cl2NO5S/c1-11(2)9-21(20(28)29)10-13(19(26)27)17(16-4-3-7-30-16)24(21)18(25)12-5-6-14(22)15(23)8-12/h3-8,11,13,17H,9-10H2,1-2H3,(H,26,27)(H,28,29)/t13-,17+,21-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	600	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory concentration against Hepatitis C virus RNA dependent RNA polymerase Nonstructural protein 5B				Bioorg Med Chem Lett 15: 1553-6 (2005) Article DOI: 10.1016/j.bmcl.2005.01.076 BindingDB Entry DOI: 10.7270/Q269732C
					More data for this Ligand-Target Pair
RNA-directed RNA polymerase (Hepatitis C virus)	BDBM50162517 ((2S,4S,5R)-2-Isobutyl-5-thiophen-2-yl-1-(3-trifluo...) Show SMILES CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)c1cccc(c1)C(F)(F)F)c1cccs1)C(O)=O)C(O)=O Show InChI InChI=1S/C22H22F3NO5S/c1-12(2)10-21(20(30)31)11-15(19(28)29)17(16-7-4-8-32-16)26(21)18(27)13-5-3-6-14(9-13)22(23,24)25/h3-9,12,15,17H,10-11H2,1-2H3,(H,28,29)(H,30,31)/t15-,17+,21-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	600	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory concentration against Hepatitis C virus RNA dependent RNA polymerase Nonstructural protein 5B				Bioorg Med Chem Lett 15: 1553-6 (2005) Article DOI: 10.1016/j.bmcl.2005.01.076 BindingDB Entry DOI: 10.7270/Q269732C
					More data for this Ligand-Target Pair
RNA-directed RNA polymerase (Hepatitis C virus)	BDBM50162513 ((2S,4S,5R)-2-(3-Methyl-butyl)-5-phenyl-1-(4-triflu...) Show SMILES CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccc(cc1)C(F)(F)F)c1ccccc1)C(O)=O)C(O)=O Show InChI InChI=1S/C24H24F3NO5/c1-14(2)12-23(22(32)33)13-18(21(30)31)19(15-6-4-3-5-7-15)28(23)20(29)16-8-10-17(11-9-16)24(25,26)27/h3-11,14,18-19H,12-13H2,1-2H3,(H,30,31)(H,32,33)/t18-,19-,23-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	700	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory concentration against Hepatitis C virus RNA dependent RNA polymerase Nonstructural protein 5B				Bioorg Med Chem Lett 15: 1553-6 (2005) Article DOI: 10.1016/j.bmcl.2005.01.076 BindingDB Entry DOI: 10.7270/Q269732C
					More data for this Ligand-Target Pair
RNA-directed RNA polymerase (Hepatitis C virus)	BDBM50162512 ((2S,4S,5R)-2-Isobutyl-1-(1,4,4a,8a-tetrahydro-naph...) Show SMILES CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)c1cccc2ccccc12)c1cccs1)C(O)=O)C(O)=O Show InChI InChI=1S/C25H25NO5S/c1-15(2)13-25(24(30)31)14-19(23(28)29)21(20-11-6-12-32-20)26(25)22(27)18-10-5-8-16-7-3-4-9-17(16)18/h3-12,15,19,21H,13-14H2,1-2H3,(H,28,29)(H,30,31)/t19-,21+,25-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	700	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory concentration against Hepatitis C virus RNA dependent RNA polymerase Nonstructural protein 5B				Bioorg Med Chem Lett 15: 1553-6 (2005) Article DOI: 10.1016/j.bmcl.2005.01.076 BindingDB Entry DOI: 10.7270/Q269732C
					More data for this Ligand-Target Pair
RNA-directed RNA polymerase (Hepatitis C virus)	BDBM50162516 ((2S,4S,5R)-2-Isobutyl-5-pyridin-2-yl-1-(4-trifluor...) Show SMILES CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccc(cc1)C(F)(F)F)c1ccccn1)C(O)=O)C(O)=O Show InChI InChI=1S/C23H23F3N2O5/c1-13(2)11-22(21(32)33)12-16(20(30)31)18(17-5-3-4-10-27-17)28(22)19(29)14-6-8-15(9-7-14)23(24,25)26/h3-10,13,16,18H,11-12H2,1-2H3,(H,30,31)(H,32,33)/t16-,18+,22-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	700	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory concentration against Hepatitis C virus RNA dependent RNA polymerase Nonstructural protein 5B				Bioorg Med Chem Lett 15: 1553-6 (2005) Article DOI: 10.1016/j.bmcl.2005.01.076 BindingDB Entry DOI: 10.7270/Q269732C
					More data for this Ligand-Target Pair
RNA-directed RNA polymerase (Hepatitis C virus)	BDBM50162521 ((2S,4S,5R)-5-Furan-2-yl-2-isobutyl-1-(4-trifluorom...) Show SMILES CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccc(cc1)C(F)(F)F)c1ccco1)C(O)=O)C(O)=O Show InChI InChI=1S/C22H22F3NO6/c1-12(2)10-21(20(30)31)11-15(19(28)29)17(16-4-3-9-32-16)26(21)18(27)13-5-7-14(8-6-13)22(23,24)25/h3-9,12,15,17H,10-11H2,1-2H3,(H,28,29)(H,30,31)/t15-,17+,21-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	800	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory concentration against Hepatitis C virus RNA dependent RNA polymerase Nonstructural protein 5B				Bioorg Med Chem Lett 15: 1553-6 (2005) Article DOI: 10.1016/j.bmcl.2005.01.076 BindingDB Entry DOI: 10.7270/Q269732C
					More data for this Ligand-Target Pair
RNA-directed RNA polymerase (Hepatitis C virus)	BDBM50162510 ((2S,4S,5R)-5-(4-Chloro-phenyl)-2-isobutyl-1-(4-tri...) Show SMILES CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccc(cc1)C(F)(F)F)c1ccc(Cl)cc1)C(O)=O)C(O)=O Show InChI InChI=1S/C24H23ClF3NO5/c1-13(2)11-23(22(33)34)12-18(21(31)32)19(14-5-9-17(25)10-6-14)29(23)20(30)15-3-7-16(8-4-15)24(26,27)28/h3-10,13,18-19H,11-12H2,1-2H3,(H,31,32)(H,33,34)/t18-,19-,23-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	900	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory concentration against Hepatitis C virus RNA dependent RNA polymerase Nonstructural protein 5B				Bioorg Med Chem Lett 15: 1553-6 (2005) Article DOI: 10.1016/j.bmcl.2005.01.076 BindingDB Entry DOI: 10.7270/Q269732C
					More data for this Ligand-Target Pair
RNA-directed RNA polymerase (Hepatitis C virus)	BDBM50162525 ((2S,4S,5R)-2-Isobutyl-5-p-tolyl-1-(4-trifluorometh...) Show SMILES CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccc(cc1)C(F)(F)F)c1ccc(C)cc1)C(O)=O)C(O)=O Show InChI InChI=1S/C25H26F3NO5/c1-14(2)12-24(23(33)34)13-19(22(31)32)20(16-6-4-15(3)5-7-16)29(24)21(30)17-8-10-18(11-9-17)25(26,27)28/h4-11,14,19-20H,12-13H2,1-3H3,(H,31,32)(H,33,34)/t19-,20-,24-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory concentration against Hepatitis C virus RNA dependent RNA polymerase Nonstructural protein 5B				Bioorg Med Chem Lett 15: 1553-6 (2005) Article DOI: 10.1016/j.bmcl.2005.01.076 BindingDB Entry DOI: 10.7270/Q269732C
					More data for this Ligand-Target Pair
RNA-directed RNA polymerase (Hepatitis C virus)	BDBM50162509 ((2S,4S,5R)-1-(4-Chloro-benzoyl)-2-isobutyl-5-thiop...) Show SMILES CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccc(Cl)cc1)c1cccs1)C(O)=O)C(O)=O Show InChI InChI=1S/C21H22ClNO5S/c1-12(2)10-21(20(27)28)11-15(19(25)26)17(16-4-3-9-29-16)23(21)18(24)13-5-7-14(22)8-6-13/h3-9,12,15,17H,10-11H2,1-2H3,(H,25,26)(H,27,28)/t15-,17+,21-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory concentration against Hepatitis C virus RNA dependent RNA polymerase Nonstructural protein 5B				Bioorg Med Chem Lett 15: 1553-6 (2005) Article DOI: 10.1016/j.bmcl.2005.01.076 BindingDB Entry DOI: 10.7270/Q269732C
					More data for this Ligand-Target Pair
RNA-directed RNA polymerase (Hepatitis C virus)	BDBM50162530 ((2R,4S,5R)-2-Benzyl-5-phenyl-1-(4-trifluoromethyl-...) Show SMILES OC(=O)[C@H]1C[C@](Cc2ccccc2)(N([C@H]1c1ccccc1)C(=O)c1ccc(cc1)C(F)(F)F)C(O)=O Show InChI InChI=1S/C27H22F3NO5/c28-27(29,30)20-13-11-19(12-14-20)23(32)31-22(18-9-5-2-6-10-18)21(24(33)34)16-26(31,25(35)36)15-17-7-3-1-4-8-17/h1-14,21-22H,15-16H2,(H,33,34)(H,35,36)/t21-,22-,26-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory concentration against Hepatitis C virus RNA dependent RNA polymerase Nonstructural protein 5B				Bioorg Med Chem Lett 15: 1553-6 (2005) Article DOI: 10.1016/j.bmcl.2005.01.076 BindingDB Entry DOI: 10.7270/Q269732C
					More data for this Ligand-Target Pair
RNA-directed RNA polymerase (Hepatitis C virus)	BDBM50162520 ((2S,4S,5R)-2-Isobutyl-1-(4-nitro-benzoyl)-5-thioph...) Show SMILES CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccc(cc1)[N+]([O-])=O)c1cccs1)C(O)=O)C(O)=O Show InChI InChI=1S/C21H22N2O7S/c1-12(2)10-21(20(27)28)11-15(19(25)26)17(16-4-3-9-31-16)22(21)18(24)13-5-7-14(8-6-13)23(29)30/h3-9,12,15,17H,10-11H2,1-2H3,(H,25,26)(H,27,28)/t15-,17+,21-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory concentration against Hepatitis C virus RNA dependent RNA polymerase Nonstructural protein 5B				Bioorg Med Chem Lett 15: 1553-6 (2005) Article DOI: 10.1016/j.bmcl.2005.01.076 BindingDB Entry DOI: 10.7270/Q269732C
					More data for this Ligand-Target Pair
RNA-directed RNA polymerase (Hepatitis C virus)	BDBM50162524 ((2S,4S,5R)-2-Butyl-5-phenyl-1-(4-trifluoromethyl-b...) Show SMILES CCCC[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccc(cc1)C(F)(F)F)c1ccccc1)C(O)=O)C(O)=O Show InChI InChI=1S/C24H24F3NO5/c1-2-3-13-23(22(32)33)14-18(21(30)31)19(15-7-5-4-6-8-15)28(23)20(29)16-9-11-17(12-10-16)24(25,26)27/h4-12,18-19H,2-3,13-14H2,1H3,(H,30,31)(H,32,33)/t18-,19-,23-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory concentration against Hepatitis C virus RNA dependent RNA polymerase Nonstructural protein 5B				Bioorg Med Chem Lett 15: 1553-6 (2005) Article DOI: 10.1016/j.bmcl.2005.01.076 BindingDB Entry DOI: 10.7270/Q269732C
					More data for this Ligand-Target Pair
RNA-directed RNA polymerase (Hepatitis C virus)	BDBM50162529 ((2S,4S,5R)-2-Isobutyl-5-(2-methoxy-phenyl)-1-(4-tr...) Show SMILES COc1ccccc1[C@H]1[C@H](C[C@](CC(C)C)(N1C(=O)c1ccc(cc1)C(F)(F)F)C(O)=O)C(O)=O Show InChI InChI=1S/C25H26F3NO6/c1-14(2)12-24(23(33)34)13-18(22(31)32)20(17-6-4-5-7-19(17)35-3)29(24)21(30)15-8-10-16(11-9-15)25(26,27)28/h4-11,14,18,20H,12-13H2,1-3H3,(H,31,32)(H,33,34)/t18-,20-,24-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory concentration against Hepatitis C virus RNA dependent RNA polymerase Nonstructural protein 5B				Bioorg Med Chem Lett 15: 1553-6 (2005) Article DOI: 10.1016/j.bmcl.2005.01.076 BindingDB Entry DOI: 10.7270/Q269732C
					More data for this Ligand-Target Pair
RNA-directed RNA polymerase (Hepatitis C virus)	BDBM50162508 ((2S,4S)-1-(4-Trifluoromethyl-benzoyl)-pyrrolidine-...) Show SMILES OC(=O)[C@H]1C[C@H](N(C1)C(=O)c1ccc(cc1)C(F)(F)F)C(O)=O Show InChI InChI=1S/C14H12F3NO5/c15-14(16,17)9-3-1-7(2-4-9)11(19)18-6-8(12(20)21)5-10(18)13(22)23/h1-4,8,10H,5-6H2,(H,20,21)(H,22,23)/t8-,10-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory concentration against Hepatitis C virus RNA dependent RNA polymerase Nonstructural protein 5B				Bioorg Med Chem Lett 15: 1553-6 (2005) Article DOI: 10.1016/j.bmcl.2005.01.076 BindingDB Entry DOI: 10.7270/Q269732C
					More data for this Ligand-Target Pair
RNA-directed RNA polymerase (Hepatitis C virus)	BDBM50162523 ((2S,4S,5R)-1-Benzoyl-2-isobutyl-5-thiophen-2-yl-py...) Show SMILES CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccccc1)c1cccs1)C(O)=O)C(O)=O Show InChI InChI=1S/C21H23NO5S/c1-13(2)11-21(20(26)27)12-15(19(24)25)17(16-9-6-10-28-16)22(21)18(23)14-7-4-3-5-8-14/h3-10,13,15,17H,11-12H2,1-2H3,(H,24,25)(H,26,27)/t15-,17+,21-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.14E+4	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory concentration against Hepatitis C virus RNA dependent RNA polymerase Nonstructural protein 5B				Bioorg Med Chem Lett 15: 1553-6 (2005) Article DOI: 10.1016/j.bmcl.2005.01.076 BindingDB Entry DOI: 10.7270/Q269732C
					More data for this Ligand-Target Pair
RNA-directed RNA polymerase (Hepatitis C virus)	BDBM50162533 ((2S,4S)-1-(3,4-Dichloro-benzoyl)-pyrrolidine-2,4-d...) Show SMILES OC(=O)[C@H]1C[C@H](N(C1)C(=O)c1ccc(Cl)c(Cl)c1)C(O)=O Show InChI InChI=1S/C13H11Cl2NO5/c14-8-2-1-6(3-9(8)15)11(17)16-5-7(12(18)19)4-10(16)13(20)21/h1-3,7,10H,4-5H2,(H,18,19)(H,20,21)/t7-,10-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory concentration against Hepatitis C virus RNA dependent RNA polymerase Nonstructural protein 5B				Bioorg Med Chem Lett 15: 1553-6 (2005) Article DOI: 10.1016/j.bmcl.2005.01.076 BindingDB Entry DOI: 10.7270/Q269732C
					More data for this Ligand-Target Pair
RNA-directed RNA polymerase (Hepatitis C virus)	BDBM50162511 ((2S,4S,5R)-2-Isobutyl-5-thiophen-2-yl-1-(4-trifluo...) Show SMILES CC(C)C[C@]1(C[C@@H]([C@H](N1C(=O)c1ccc(cc1)C(F)(F)F)c1cccs1)C(O)=O)C(O)=O Show InChI InChI=1S/C22H22F3NO5S/c1-12(2)10-21(20(30)31)11-15(19(28)29)17(16-4-3-9-32-16)26(21)18(27)13-5-7-14(8-6-13)22(23,24)25/h3-9,12,15,17H,10-11H2,1-2H3,(H,28,29)(H,30,31)/t15-,17-,21-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory concentration against Hepatitis C virus RNA dependent RNA polymerase Nonstructural protein 5B				Bioorg Med Chem Lett 15: 1553-6 (2005) Article DOI: 10.1016/j.bmcl.2005.01.076 BindingDB Entry DOI: 10.7270/Q269732C
					More data for this Ligand-Target Pair
RNA-directed RNA polymerase (Hepatitis C virus)	BDBM50162532 ((2S,4S,5R)-2-Methyl-5-phenyl-1-(4-trifluoromethyl-...) Show SMILES C[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccc(cc1)C(F)(F)F)c1ccccc1)C(O)=O)C(O)=O Show InChI InChI=1S/C21H18F3NO5/c1-20(19(29)30)11-15(18(27)28)16(12-5-3-2-4-6-12)25(20)17(26)13-7-9-14(10-8-13)21(22,23)24/h2-10,15-16H,11H2,1H3,(H,27,28)(H,29,30)/t15-,16-,20-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory concentration against Hepatitis C virus RNA dependent RNA polymerase Nonstructural protein 5B				Bioorg Med Chem Lett 15: 1553-6 (2005) Article DOI: 10.1016/j.bmcl.2005.01.076 BindingDB Entry DOI: 10.7270/Q269732C
					More data for this Ligand-Target Pair
RNA-directed RNA polymerase (Hepatitis C virus)	BDBM50162515 ((2S,4S,5R)-2-Isobutyl-1-(pyridine-4-carbonyl)-5-th...) Show SMILES CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccncc1)c1cccs1)C(O)=O)C(O)=O Show InChI InChI=1S/C20H22N2O5S/c1-12(2)10-20(19(26)27)11-14(18(24)25)16(15-4-3-9-28-15)22(20)17(23)13-5-7-21-8-6-13/h3-9,12,14,16H,10-11H2,1-2H3,(H,24,25)(H,26,27)/t14-,16+,20-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory concentration against Hepatitis C virus RNA dependent RNA polymerase Nonstructural protein 5B				Bioorg Med Chem Lett 15: 1553-6 (2005) Article DOI: 10.1016/j.bmcl.2005.01.076 BindingDB Entry DOI: 10.7270/Q269732C
					More data for this Ligand-Target Pair
RNA-directed RNA polymerase (Hepatitis C virus)	BDBM50162514 ((2S,4S,5R)-2-(2-Carboxy-ethyl)-5-phenyl-1-(4-trifl...) Show SMILES OC(=O)CC[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccc(cc1)C(F)(F)F)c1ccccc1)C(O)=O)C(O)=O Show InChI InChI=1S/C23H20F3NO7/c24-23(25,26)15-8-6-14(7-9-15)19(30)27-18(13-4-2-1-3-5-13)16(20(31)32)12-22(27,21(33)34)11-10-17(28)29/h1-9,16,18H,10-12H2,(H,28,29)(H,31,32)(H,33,34)/t16-,18-,22-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory concentration against Hepatitis C virus RNA dependent RNA polymerase Nonstructural protein 5B				Bioorg Med Chem Lett 15: 1553-6 (2005) Article DOI: 10.1016/j.bmcl.2005.01.076 BindingDB Entry DOI: 10.7270/Q269732C
					More data for this Ligand-Target Pair
RNA-directed RNA polymerase (Hepatitis C virus)	BDBM50162522 ((2S,4S,5R)-2-Isobutyl-5-thiophen-2-yl-1-(2-trifluo...) Show SMILES CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccccc1C(F)(F)F)c1cccs1)C(O)=O)C(O)=O Show InChI InChI=1S/C22H22F3NO5S/c1-12(2)10-21(20(30)31)11-14(19(28)29)17(16-8-5-9-32-16)26(21)18(27)13-6-3-4-7-15(13)22(23,24)25/h3-9,12,14,17H,10-11H2,1-2H3,(H,28,29)(H,30,31)/t14-,17+,21-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory concentration against Hepatitis C virus RNA dependent RNA polymerase Nonstructural protein 5B				Bioorg Med Chem Lett 15: 1553-6 (2005) Article DOI: 10.1016/j.bmcl.2005.01.076 BindingDB Entry DOI: 10.7270/Q269732C
					More data for this Ligand-Target Pair
RNA-directed RNA polymerase (Hepatitis C virus)	BDBM50162534 ((2S,4S,5R)-1-Heptanoyl-2-isobutyl-5-thiophen-2-yl-...) Show SMILES CCCCCCC(=O)N1[C@H]([C@H](C[C@@]1(CC(C)C)C(O)=O)C(O)=O)c1cccs1 Show InChI InChI=1S/C21H31NO5S/c1-4-5-6-7-10-17(23)22-18(16-9-8-11-28-16)15(19(24)25)13-21(22,20(26)27)12-14(2)3/h8-9,11,14-15,18H,4-7,10,12-13H2,1-3H3,(H,24,25)(H,26,27)/t15-,18+,21-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory concentration against Hepatitis C virus RNA dependent RNA polymerase Nonstructural protein 5B				Bioorg Med Chem Lett 15: 1553-6 (2005) Article DOI: 10.1016/j.bmcl.2005.01.076 BindingDB Entry DOI: 10.7270/Q269732C
					More data for this Ligand-Target Pair
RNA-directed RNA polymerase (Hepatitis C virus)	BDBM50162528 ((2R,4S,5R)-2-(4-Hydroxy-benzyl)-5-phenyl-1-(4-trif...) Show SMILES OC(=O)[C@H]1C[C@](Cc2ccc(O)cc2)(N([C@H]1c1ccccc1)C(=O)c1ccc(cc1)C(F)(F)F)C(O)=O Show InChI InChI=1S/C27H22F3NO6/c28-27(29,30)19-10-8-18(9-11-19)23(33)31-22(17-4-2-1-3-5-17)21(24(34)35)15-26(31,25(36)37)14-16-6-12-20(32)13-7-16/h1-13,21-22,32H,14-15H2,(H,34,35)(H,36,37)/t21-,22-,26-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory concentration against Hepatitis C virus RNA dependent RNA polymerase Nonstructural protein 5B				Bioorg Med Chem Lett 15: 1553-6 (2005) Article DOI: 10.1016/j.bmcl.2005.01.076 BindingDB Entry DOI: 10.7270/Q269732C
					More data for this Ligand-Target Pair
RNA-directed RNA polymerase (Hepatitis C virus)	BDBM50162526 ((2S,4S,5R)-2-(3-Amino-propyl)-5-phenyl-1-(4-triflu...) Show SMILES NCCC[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccc(cc1)C(F)(F)F)c1ccccc1)C(O)=O)C(O)=O Show InChI InChI=1S/C23H23F3N2O5/c24-23(25,26)16-9-7-15(8-10-16)19(29)28-18(14-5-2-1-3-6-14)17(20(30)31)13-22(28,21(32)33)11-4-12-27/h1-3,5-10,17-18H,4,11-13,27H2,(H,30,31)(H,32,33)/t17-,18-,22-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory concentration against Hepatitis C virus RNA dependent RNA polymerase Nonstructural protein 5B				Bioorg Med Chem Lett 15: 1553-6 (2005) Article DOI: 10.1016/j.bmcl.2005.01.076 BindingDB Entry DOI: 10.7270/Q269732C
					More data for this Ligand-Target Pair
Protein-serine O-palmitoleoyltransferase porcupine (Mus musculus)	BDBM50427998 (CHEMBL2322630) Show SMILES COc1ccc2nc(NC(=O)CNC(=O)c3nn(-c4ccccc4)c(=O)c4ccccc34)sc2c1 Show InChI InChI=1S/C25H19N5O4S/c1-34-16-11-12-19-20(13-16)35-25(27-19)28-21(31)14-26-23(32)22-17-9-5-6-10-18(17)24(33)30(29-22)15-7-3-2-4-8-15/h2-13H,14H2,1H3,(H,26,32)(H,27,28,31)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	210	n/a	n/a	n/a	n/a
The University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of porcupine-mediated Wnt signalling in mouse L cells after 24 hrs by SpringerImages-Topflash reporter assay				J Med Chem 56: 2700-4 (2013) Article DOI: 10.1021/jm400159c BindingDB Entry DOI: 10.7270/Q2TD9ZP5
					More data for this Ligand-Target Pair
Protein-serine O-palmitoleoyltransferase porcupine (Mus musculus)	BDBM50428058 (CHEMBL2322631) Show SMILES COc1ccc2nc(NC(=O)CNC(=O)c3nn(-c4ccc(F)cc4)c(=O)c4ccccc34)sc2c1 Show InChI InChI=1S/C25H18FN5O4S/c1-35-16-10-11-19-20(12-16)36-25(28-19)29-21(32)13-27-23(33)22-17-4-2-3-5-18(17)24(34)31(30-22)15-8-6-14(26)7-9-15/h2-12H,13H2,1H3,(H,27,33)(H,28,29,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	90	n/a	n/a	n/a	n/a
The University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of porcupine-mediated Wnt signalling in mouse L cells after 24 hrs by SpringerImages-Topflash reporter assay				J Med Chem 56: 2700-4 (2013) Article DOI: 10.1021/jm400159c BindingDB Entry DOI: 10.7270/Q2TD9ZP5
					More data for this Ligand-Target Pair
Protein-serine O-palmitoleoyltransferase porcupine (Mus musculus)	BDBM50428000 (CHEMBL2322628) Show SMILES O=C(CSc1nc2CCSc2c(=O)n1-c1ccccc1)Nc1ncc(cn1)-c1ccoc1 Show InChI InChI=1S/C22H17N5O3S2/c28-18(26-21-23-10-15(11-24-21)14-6-8-30-12-14)13-32-22-25-17-7-9-31-19(17)20(29)27(22)16-4-2-1-3-5-16/h1-6,8,10-12H,7,9,13H2,(H,23,24,26,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.5	n/a	n/a	n/a	n/a
The University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of porcupine-mediated Wnt signalling in mouse L cells after 24 hrs by SpringerImages-Topflash reporter assay				J Med Chem 56: 2700-4 (2013) Article DOI: 10.1021/jm400159c BindingDB Entry DOI: 10.7270/Q2TD9ZP5
					More data for this Ligand-Target Pair
Protein-serine O-palmitoleoyltransferase porcupine (Mus musculus)	BDBM50428001 (CHEMBL2322627) Show SMILES O=C(CSc1nc2CCSc2c(=O)n1-c1ccccc1)Nc1ccc(cn1)-c1cccs1 Show InChI InChI=1S/C23H18N4O2S3/c28-20(26-19-9-8-15(13-24-19)18-7-4-11-30-18)14-32-23-25-17-10-12-31-21(17)22(29)27(23)16-5-2-1-3-6-16/h1-9,11,13H,10,12,14H2,(H,24,26,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.300	n/a	n/a	n/a	n/a
The University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of porcupine-mediated Wnt signalling in mouse L cells after 24 hrs by SpringerImages-Topflash reporter assay				J Med Chem 56: 2700-4 (2013) Article DOI: 10.1021/jm400159c BindingDB Entry DOI: 10.7270/Q2TD9ZP5
					More data for this Ligand-Target Pair
Protein-serine O-palmitoleoyltransferase porcupine (Mus musculus)	BDBM50428002 (CHEMBL2322626) Show SMILES O=C(CSc1nc2CCSc2c(=O)n1-c1ccccc1)Nc1ccc(cn1)-c1ccsc1 Show InChI InChI=1S/C23H18N4O2S3/c28-20(26-19-7-6-15(12-24-19)16-8-10-30-13-16)14-32-23-25-18-9-11-31-21(18)22(29)27(23)17-4-2-1-3-5-17/h1-8,10,12-13H,9,11,14H2,(H,24,26,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	2	n/a	n/a	n/a	n/a
The University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of porcupine-mediated Wnt signalling in mouse L cells after 24 hrs by SpringerImages-Topflash reporter assay				J Med Chem 56: 2700-4 (2013) Article DOI: 10.1021/jm400159c BindingDB Entry DOI: 10.7270/Q2TD9ZP5
					More data for this Ligand-Target Pair
Protein-serine O-palmitoleoyltransferase porcupine (Mus musculus)	BDBM50428003 (CHEMBL2322625) Show SMILES O=C(CSc1nc2CCSc2c(=O)n1-c1ccccc1)Nc1ccc(cn1)-c1ccco1 Show InChI InChI=1S/C23H18N4O3S2/c28-20(26-19-9-8-15(13-24-19)18-7-4-11-30-18)14-32-23-25-17-10-12-31-21(17)22(29)27(23)16-5-2-1-3-6-16/h1-9,11,13H,10,12,14H2,(H,24,26,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	3.5	n/a	n/a	n/a	n/a
The University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of porcupine-mediated Wnt signalling in mouse L cells after 24 hrs by SpringerImages-Topflash reporter assay				J Med Chem 56: 2700-4 (2013) Article DOI: 10.1021/jm400159c BindingDB Entry DOI: 10.7270/Q2TD9ZP5
					More data for this Ligand-Target Pair
Protein-serine O-palmitoleoyltransferase porcupine (Mus musculus)	BDBM50428004 (CHEMBL2322624) Show SMILES O=C(CSc1nc2CCSc2c(=O)n1-c1ccccc1)Nc1ccc(cn1)-c1ccoc1 Show InChI InChI=1S/C23H18N4O3S2/c28-20(26-19-7-6-15(12-24-19)16-8-10-30-13-16)14-32-23-25-18-9-11-31-21(18)22(29)27(23)17-4-2-1-3-5-17/h1-8,10,12-13H,9,11,14H2,(H,24,26,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.5	n/a	n/a	n/a	n/a
The University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of porcupine-mediated Wnt signalling in mouse L cells after 24 hrs by SpringerImages-Topflash reporter assay				J Med Chem 56: 2700-4 (2013) Article DOI: 10.1021/jm400159c BindingDB Entry DOI: 10.7270/Q2TD9ZP5
					More data for this Ligand-Target Pair
Protein-serine O-palmitoleoyltransferase porcupine (Mus musculus)	BDBM50428005 (CHEMBL2322623) Show SMILES O=C(CSc1nc2CCSc2c(=O)n1-c1ccccc1)Nc1ccc(cn1)-c1cncnc1 Show InChI InChI=1S/C23H18N6O2S2/c30-20(28-19-7-6-15(12-26-19)16-10-24-14-25-11-16)13-33-23-27-18-8-9-32-21(18)22(31)29(23)17-4-2-1-3-5-17/h1-7,10-12,14H,8-9,13H2,(H,26,28,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	5.5	n/a	n/a	n/a	n/a
The University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of porcupine-mediated Wnt signalling in mouse L cells after 24 hrs by SpringerImages-Topflash reporter assay				J Med Chem 56: 2700-4 (2013) Article DOI: 10.1021/jm400159c BindingDB Entry DOI: 10.7270/Q2TD9ZP5
					More data for this Ligand-Target Pair
Protein-serine O-palmitoleoyltransferase porcupine (Mus musculus)	BDBM50428006 (CHEMBL2323233) Show SMILES O=C(CSc1nc2CCSc2c(=O)n1-c1ccccc1)Nc1ccc(cn1)-c1cccnc1 Show InChI InChI=1S/C24H19N5O2S2/c30-21(28-20-9-8-17(14-26-20)16-5-4-11-25-13-16)15-33-24-27-19-10-12-32-22(19)23(31)29(24)18-6-2-1-3-7-18/h1-9,11,13-14H,10,12,15H2,(H,26,28,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1	n/a	n/a	n/a	n/a
The University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of porcupine-mediated Wnt signalling in mouse L cells after 24 hrs by SpringerImages-Topflash reporter assay				J Med Chem 56: 2700-4 (2013) Article DOI: 10.1021/jm400159c BindingDB Entry DOI: 10.7270/Q2TD9ZP5
					More data for this Ligand-Target Pair
Protein-serine O-palmitoleoyltransferase porcupine (Mus musculus)	BDBM50428007 (CHEMBL2323232) Show SMILES O=C(CSc1nc2CCSc2c(=O)n1-c1ccccc1)Nc1ncc(cn1)-c1ccccc1 Show InChI InChI=1S/C24H19N5O2S2/c30-20(28-23-25-13-17(14-26-23)16-7-3-1-4-8-16)15-33-24-27-19-11-12-32-21(19)22(31)29(24)18-9-5-2-6-10-18/h1-10,13-14H,11-12,15H2,(H,25,26,28,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	15	n/a	n/a	n/a	n/a
The University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of porcupine-mediated Wnt signalling in mouse L cells after 24 hrs by SpringerImages-Topflash reporter assay				J Med Chem 56: 2700-4 (2013) Article DOI: 10.1021/jm400159c BindingDB Entry DOI: 10.7270/Q2TD9ZP5
					More data for this Ligand-Target Pair
Protein-serine O-palmitoleoyltransferase porcupine (Mus musculus)	BDBM50428008 (CHEMBL2323231) Show SMILES O=C(CSc1nc2CCSc2c(=O)n1-c1ccccc1)Nc1ccc(cn1)-c1ccccc1 Show InChI InChI=1S/C25H20N4O2S2/c30-22(28-21-12-11-18(15-26-21)17-7-3-1-4-8-17)16-33-25-27-20-13-14-32-23(20)24(31)29(25)19-9-5-2-6-10-19/h1-12,15H,13-14,16H2,(H,26,28,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.5	n/a	n/a	n/a	n/a
The University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of porcupine-mediated Wnt signalling in mouse L cells after 24 hrs by SpringerImages-Topflash reporter assay				J Med Chem 56: 2700-4 (2013) Article DOI: 10.1021/jm400159c BindingDB Entry DOI: 10.7270/Q2TD9ZP5
					More data for this Ligand-Target Pair
Protein-serine O-palmitoleoyltransferase porcupine (Mus musculus)	BDBM50428009 (CHEMBL2323230) Show SMILES O=C(CSc1nc2CCSc2c(=O)n1-c1ccccc1)Nc1ccc(nc1)-c1ccccc1 Show InChI InChI=1S/C25H20N4O2S2/c30-22(27-18-11-12-20(26-15-18)17-7-3-1-4-8-17)16-33-25-28-21-13-14-32-23(21)24(31)29(25)19-9-5-2-6-10-19/h1-12,15H,13-14,16H2,(H,27,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.300	n/a	n/a	n/a	n/a
The University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of porcupine-mediated Wnt signalling in mouse L cells after 24 hrs by SpringerImages-Topflash reporter assay				J Med Chem 56: 2700-4 (2013) Article DOI: 10.1021/jm400159c BindingDB Entry DOI: 10.7270/Q2TD9ZP5
					More data for this Ligand-Target Pair
Protein-serine O-palmitoleoyltransferase porcupine (Mus musculus)	BDBM50428010 (CHEMBL2323229) Show SMILES O=C(CSc1nc2CCSc2c(=O)n1-c1ccccc1)Nc1ccc(cc1)-c1ccncc1 Show InChI InChI=1S/C25H20N4O2S2/c30-22(27-19-8-6-17(7-9-19)18-10-13-26-14-11-18)16-33-25-28-21-12-15-32-23(21)24(31)29(25)20-4-2-1-3-5-20/h1-11,13-14H,12,15-16H2,(H,27,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	3	n/a	n/a	n/a	n/a
The University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of porcupine-mediated Wnt signalling in mouse L cells after 24 hrs by SpringerImages-Topflash reporter assay				J Med Chem 56: 2700-4 (2013) Article DOI: 10.1021/jm400159c BindingDB Entry DOI: 10.7270/Q2TD9ZP5
					More data for this Ligand-Target Pair
Protein-serine O-palmitoleoyltransferase porcupine (Mus musculus)	BDBM50428011 (CHEMBL2323228) Show SMILES O=C(CSc1nc2CCSc2c(=O)n1-c1ccccc1)Nc1ccc(cc1)-c1cccnc1 Show InChI InChI=1S/C25H20N4O2S2/c30-22(27-19-10-8-17(9-11-19)18-5-4-13-26-15-18)16-33-25-28-21-12-14-32-23(21)24(31)29(25)20-6-2-1-3-7-20/h1-11,13,15H,12,14,16H2,(H,27,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.450	n/a	n/a	n/a	n/a
The University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of porcupine-mediated Wnt signalling in mouse L cells after 24 hrs by SpringerImages-Topflash reporter assay				J Med Chem 56: 2700-4 (2013) Article DOI: 10.1021/jm400159c BindingDB Entry DOI: 10.7270/Q2TD9ZP5
					More data for this Ligand-Target Pair
Protein-serine O-palmitoleoyltransferase porcupine (Mus musculus)	BDBM50428012 (CHEMBL2322635) Show SMILES O=C(CSc1nc2CCSc2c(=O)n1-c1ccccc1)Nc1ccc(cc1)-c1ccccn1 Show InChI InChI=1S/C25H20N4O2S2/c30-22(27-18-11-9-17(10-12-18)20-8-4-5-14-26-20)16-33-25-28-21-13-15-32-23(21)24(31)29(25)19-6-2-1-3-7-19/h1-12,14H,13,15-16H2,(H,27,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	4	n/a	n/a	n/a	n/a
The University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of porcupine-mediated Wnt signalling in mouse L cells after 24 hrs by SpringerImages-Topflash reporter assay				J Med Chem 56: 2700-4 (2013) Article DOI: 10.1021/jm400159c BindingDB Entry DOI: 10.7270/Q2TD9ZP5
					More data for this Ligand-Target Pair
Protein-serine O-palmitoleoyltransferase porcupine (Mus musculus)	BDBM50428013 (CHEMBL2322634) Show SMILES O=C(CSc1nc2CCSc2c(=O)n1-c1ccccc1)Nc1ccccc1-c1ccccc1 Show InChI InChI=1S/C26H21N3O2S2/c30-23(27-21-14-8-7-13-20(21)18-9-3-1-4-10-18)17-33-26-28-22-15-16-32-24(22)25(31)29(26)19-11-5-2-6-12-19/h1-14H,15-17H2,(H,27,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a
The University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of porcupine-mediated Wnt signalling in mouse L cells after 24 hrs by SpringerImages-Topflash reporter assay				J Med Chem 56: 2700-4 (2013) Article DOI: 10.1021/jm400159c BindingDB Entry DOI: 10.7270/Q2TD9ZP5
					More data for this Ligand-Target Pair
Protein-serine O-palmitoleoyltransferase porcupine (Mus musculus)	BDBM50428014 (CHEMBL2322633) Show SMILES O=C(CSc1nc2CCSc2c(=O)n1-c1ccccc1)Nc1cccc(c1)-c1ccccc1 Show InChI InChI=1S/C26H21N3O2S2/c30-23(27-20-11-7-10-19(16-20)18-8-3-1-4-9-18)17-33-26-28-22-14-15-32-24(22)25(31)29(26)21-12-5-2-6-13-21/h1-13,16H,14-15,17H2,(H,27,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a
The University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of porcupine-mediated Wnt signalling in mouse L cells after 24 hrs by SpringerImages-Topflash reporter assay				J Med Chem 56: 2700-4 (2013) Article DOI: 10.1021/jm400159c BindingDB Entry DOI: 10.7270/Q2TD9ZP5
					More data for this Ligand-Target Pair
Protein-serine O-palmitoleoyltransferase porcupine (Mus musculus)	BDBM50428015 (CHEMBL2322632) Show SMILES O=C(CSc1nc2CCSc2c(=O)n1-c1ccccc1)Nc1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C26H21N3O2S2/c30-23(27-20-13-11-19(12-14-20)18-7-3-1-4-8-18)17-33-26-28-22-15-16-32-24(22)25(31)29(26)21-9-5-2-6-10-21/h1-14H,15-17H2,(H,27,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.75	n/a	n/a	n/a	n/a
The University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of porcupine-mediated Wnt signalling in mouse L cells after 24 hrs by SpringerImages-Topflash reporter assay				J Med Chem 56: 2700-4 (2013) Article DOI: 10.1021/jm400159c BindingDB Entry DOI: 10.7270/Q2TD9ZP5
					More data for this Ligand-Target Pair
Protein-serine O-palmitoleoyltransferase porcupine (Mus musculus)	BDBM50428016 (CHEMBL2323243) Show SMILES O=C(CSc1nc2CCSc2c(=O)n1-c1ccccc1)Nc1ccc(cc1)N1CCCCC1 Show InChI InChI=1S/C25H26N4O2S2/c30-22(26-18-9-11-19(12-10-18)28-14-5-2-6-15-28)17-33-25-27-21-13-16-32-23(21)24(31)29(25)20-7-3-1-4-8-20/h1,3-4,7-12H,2,5-6,13-17H2,(H,26,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	30	n/a	n/a	n/a	n/a
The University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of porcupine-mediated Wnt signalling in mouse L cells after 24 hrs by SpringerImages-Topflash reporter assay				J Med Chem 56: 2700-4 (2013) Article DOI: 10.1021/jm400159c BindingDB Entry DOI: 10.7270/Q2TD9ZP5
					More data for this Ligand-Target Pair
Protein-serine O-palmitoleoyltransferase porcupine (Mus musculus)	BDBM50428017 (CHEMBL2323242) Show SMILES CN(C)c1ccc(NC(=O)CSc2nc3CCSc3c(=O)n2-c2ccccc2)cc1 Show InChI InChI=1S/C22H22N4O2S2/c1-25(2)16-10-8-15(9-11-16)23-19(27)14-30-22-24-18-12-13-29-20(18)21(28)26(22)17-6-4-3-5-7-17/h3-11H,12-14H2,1-2H3,(H,23,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a
The University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of porcupine-mediated Wnt signalling in mouse L cells after 24 hrs by SpringerImages-Topflash reporter assay				J Med Chem 56: 2700-4 (2013) Article DOI: 10.1021/jm400159c BindingDB Entry DOI: 10.7270/Q2TD9ZP5
					More data for this Ligand-Target Pair
Protein-serine O-palmitoleoyltransferase porcupine (Mus musculus)	BDBM50428018 (CHEMBL2323241) Show SMILES CC(=O)c1ccc(NC(=O)CSc2nc3CCSc3c(=O)n2-c2ccccc2)cc1 Show InChI InChI=1S/C22H19N3O3S2/c1-14(26)15-7-9-16(10-8-15)23-19(27)13-30-22-24-18-11-12-29-20(18)21(28)25(22)17-5-3-2-4-6-17/h2-10H,11-13H2,1H3,(H,23,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a
The University of Texas Southwestern Medical Center Curated by ChEMBL					Assay Description Inhibition of porcupine-mediated Wnt signalling in mouse L cells after 24 hrs by SpringerImages-Topflash reporter assay				J Med Chem 56: 2700-4 (2013) Article DOI: 10.1021/jm400159c BindingDB Entry DOI: 10.7270/Q2TD9ZP5
					More data for this Ligand-Target Pair

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