Compile Data Set for Download or QSAR

Found 30 hits with Last Name = 'ashitha' and Initial = 'kt'   

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
Pancreatic triacylglycerol lipase (Homo sapiens (Human))	BDBM24567 ((2S)-1-[(2S,3S)-3-hexyl-4-oxooxetan-2-yl]tridecan-...) Show SMILES CCCCCCCCCCC[C@@H](C[C@@H]1OC(=O)[C@H]1CCCCCC)OC(=O)[C@H](CC(C)C)NC=O |r| Show InChI InChI=1S/C29H53NO5/c1-5-7-9-11-12-13-14-15-16-18-24(34-29(33)26(30-22-31)20-23(3)4)21-27-25(28(32)35-27)19-17-10-8-6-2/h22-27H,5-21H2,1-4H3,(H,30,31)/t24-,25-,26-,27-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem Patents Similars	DrugBank Article PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
CSIR - National Institute for Interdisciplinary Science and Technology (CSIR-NIIST) Curated by ChEMBL					Assay Description Inhibition of human pancreatic lipase using emulsified olive oil as substrate pretreated with substrate for 5 mins followed by enzyme addition and me...				ACS Med Chem Lett 9: 662-666 (2018) Article DOI: 10.1021/acsmedchemlett.8b00109 BindingDB Entry DOI: 10.7270/Q2F47RPR
					More data for this Ligand-Target Pair
Pancreatic triacylglycerol lipase (Sus scrofa (Pig))	BDBM50367145 (CHEMBL4173252) Show SMILES [H][C@@]12CCC(=C)C(C\C=C(/CC(=O)OCc3cn(Cc4ccc(F)cc4)nn3)C=O)[C@@]1(C)CCCC2(C)C |r| Show InChI InChI=1S/C30H38FN3O3/c1-21-6-13-27-29(2,3)14-5-15-30(27,4)26(21)12-9-23(19-35)16-28(36)37-20-25-18-34(33-32-25)17-22-7-10-24(31)11-8-22/h7-11,18-19,26-27H,1,5-6,12-17,20H2,2-4H3/b23-9+/t26?,27-,30+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	750	n/a	n/a	n/a	n/a	n/a	n/a
CSIR - National Institute for Interdisciplinary Science and Technology (CSIR-NIIST) Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic lipase using p-nitrophenyl butyrate as substrate pretreated for 15 mins followed by substrate addition and measured ...				ACS Med Chem Lett 9: 662-666 (2018) Article DOI: 10.1021/acsmedchemlett.8b00109 BindingDB Entry DOI: 10.7270/Q2F47RPR
					More data for this Ligand-Target Pair
Pancreatic triacylglycerol lipase (Sus scrofa (Pig))	BDBM50367138 (CHEMBL4160519) Show SMILES [H][C@@]12CCC(=C)C(C\C=C(/CC(=O)OCc3cn(Cc4ccc(Cl)cc4)nn3)C=O)[C@@]1(C)CCCC2(C)C |r| Show InChI InChI=1S/C30H38ClN3O3/c1-21-6-13-27-29(2,3)14-5-15-30(27,4)26(21)12-9-23(19-35)16-28(36)37-20-25-18-34(33-32-25)17-22-7-10-24(31)11-8-22/h7-11,18-19,26-27H,1,5-6,12-17,20H2,2-4H3/b23-9+/t26?,27-,30+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	770	n/a	n/a	n/a	n/a	n/a	n/a
CSIR - National Institute for Interdisciplinary Science and Technology (CSIR-NIIST) Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic lipase using p-nitrophenyl butyrate as substrate pretreated for 15 mins followed by substrate addition and measured ...				ACS Med Chem Lett 9: 662-666 (2018) Article DOI: 10.1021/acsmedchemlett.8b00109 BindingDB Entry DOI: 10.7270/Q2F47RPR
					More data for this Ligand-Target Pair
Pancreatic triacylglycerol lipase (Sus scrofa (Pig))	BDBM24567 ((2S)-1-[(2S,3S)-3-hexyl-4-oxooxetan-2-yl]tridecan-...) Show SMILES CCCCCCCCCCC[C@@H](C[C@@H]1OC(=O)[C@H]1CCCCCC)OC(=O)[C@H](CC(C)C)NC=O |r| Show InChI InChI=1S/C29H53NO5/c1-5-7-9-11-12-13-14-15-16-18-24(34-29(33)26(30-22-31)20-23(3)4)21-27-25(28(32)35-27)19-17-10-8-6-2/h22-27H,5-21H2,1-4H3,(H,30,31)/t24-,25-,26-,27-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	800	n/a	n/a	n/a	n/a	n/a	n/a
CSIR - National Institute for Interdisciplinary Science and Technology (CSIR-NIIST) Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic lipase using p-nitrophenyl butyrate as substrate pretreated for 15 mins followed by substrate addition and measured ...				ACS Med Chem Lett 9: 662-666 (2018) Article DOI: 10.1021/acsmedchemlett.8b00109 BindingDB Entry DOI: 10.7270/Q2F47RPR
					More data for this Ligand-Target Pair
Pancreatic triacylglycerol lipase (Sus scrofa (Pig))	BDBM50367133 (CHEMBL4164998) Show SMILES [H][C@@]12CCC(=C)C(C\C=C(/CC(=O)OCc3cn(Cc4ccc(SC)cc4)nn3)C=O)[C@@]1(C)CCCC2(C)C |r| Show InChI InChI=1S/C31H41N3O3S/c1-22-7-14-28-30(2,3)15-6-16-31(28,4)27(22)13-10-24(20-35)17-29(36)37-21-25-19-34(33-32-25)18-23-8-11-26(38-5)12-9-23/h8-12,19-20,27-28H,1,6-7,13-18,21H2,2-5H3/b24-10+/t27?,28-,31+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	800	n/a	n/a	n/a	n/a	n/a	n/a
CSIR - National Institute for Interdisciplinary Science and Technology (CSIR-NIIST) Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic lipase using p-nitrophenyl butyrate as substrate pretreated for 15 mins followed by substrate addition and measured ...				ACS Med Chem Lett 9: 662-666 (2018) Article DOI: 10.1021/acsmedchemlett.8b00109 BindingDB Entry DOI: 10.7270/Q2F47RPR
					More data for this Ligand-Target Pair
Pancreatic triacylglycerol lipase (Sus scrofa (Pig))	BDBM50367134 (CHEMBL4167341) Show SMILES [H][C@@]12CCC(=C)C(C\C=C(/CC(=O)OCc3cn(Cc4ccc(OC)cc4)nn3)C=O)[C@@]1(C)CCCC2(C)C |r| Show InChI InChI=1S/C31H41N3O4/c1-22-7-14-28-30(2,3)15-6-16-31(28,4)27(22)13-10-24(20-35)17-29(36)38-21-25-19-34(33-32-25)18-23-8-11-26(37-5)12-9-23/h8-12,19-20,27-28H,1,6-7,13-18,21H2,2-5H3/b24-10+/t27?,28-,31+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	840	n/a	n/a	n/a	n/a	n/a	n/a
CSIR - National Institute for Interdisciplinary Science and Technology (CSIR-NIIST) Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic lipase using p-nitrophenyl butyrate as substrate pretreated for 15 mins followed by substrate addition and measured ...				ACS Med Chem Lett 9: 662-666 (2018) Article DOI: 10.1021/acsmedchemlett.8b00109 BindingDB Entry DOI: 10.7270/Q2F47RPR
					More data for this Ligand-Target Pair
Pancreatic triacylglycerol lipase (Sus scrofa (Pig))	BDBM50367211 (CHEMBL4165339) Show SMILES [H][C@@]12CCC(=C)C(C\C=C(/CC(=O)OCc3cn(Cc4ccc(cc4)[N+]([O-])=O)nn3)C=O)[C@@]1(C)CCCC2(C)C |r| Show InChI InChI=1S/C30H38N4O5/c1-21-6-13-27-29(2,3)14-5-15-30(27,4)26(21)12-9-23(19-35)16-28(36)39-20-24-18-33(32-31-24)17-22-7-10-25(11-8-22)34(37)38/h7-11,18-19,26-27H,1,5-6,12-17,20H2,2-4H3/b23-9+/t26?,27-,30+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	850	n/a	n/a	n/a	n/a	n/a	n/a
CSIR - National Institute for Interdisciplinary Science and Technology (CSIR-NIIST) Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic lipase using p-nitrophenyl butyrate as substrate pretreated for 15 mins followed by substrate addition and measured ...				ACS Med Chem Lett 9: 662-666 (2018) Article DOI: 10.1021/acsmedchemlett.8b00109 BindingDB Entry DOI: 10.7270/Q2F47RPR
					More data for this Ligand-Target Pair
Pancreatic triacylglycerol lipase (Sus scrofa (Pig))	BDBM50367212 (CHEMBL4168413) Show SMILES [H][C@@]12CCC(=C)C(C\C=C(/CC(=O)OCc3cn(Cc4ccc(cc4)C(C)(C)C)nn3)C=O)[C@@]1(C)CCCC2(C)C |r| Show InChI InChI=1S/C34H47N3O3/c1-24-9-16-30-33(5,6)17-8-18-34(30,7)29(24)15-12-26(22-38)19-31(39)40-23-28-21-37(36-35-28)20-25-10-13-27(14-11-25)32(2,3)4/h10-14,21-22,29-30H,1,8-9,15-20,23H2,2-7H3/b26-12+/t29?,30-,34+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	910	n/a	n/a	n/a	n/a	n/a	n/a
CSIR - National Institute for Interdisciplinary Science and Technology (CSIR-NIIST) Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic lipase using p-nitrophenyl butyrate as substrate pretreated for 15 mins followed by substrate addition and measured ...				ACS Med Chem Lett 9: 662-666 (2018) Article DOI: 10.1021/acsmedchemlett.8b00109 BindingDB Entry DOI: 10.7270/Q2F47RPR
					More data for this Ligand-Target Pair
Pancreatic triacylglycerol lipase (Sus scrofa (Pig))	BDBM50367214 (CHEMBL4163899) Show SMILES [H][C@@]12CCC(=C)C(C\C=C(/CC(=O)OCc3cn(Cc4ccc(F)cc4Br)nn3)C=O)[C@@]1(C)CCCC2(C)C |r| Show InChI InChI=1S/C30H37BrFN3O3/c1-20-6-11-27-29(2,3)12-5-13-30(27,4)25(20)10-7-21(18-36)14-28(37)38-19-24-17-35(34-33-24)16-22-8-9-23(32)15-26(22)31/h7-9,15,17-18,25,27H,1,5-6,10-14,16,19H2,2-4H3/b21-7+/t25?,27-,30+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	950	n/a	n/a	n/a	n/a	n/a	n/a
CSIR - National Institute for Interdisciplinary Science and Technology (CSIR-NIIST) Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic lipase using p-nitrophenyl butyrate as substrate pretreated for 15 mins followed by substrate addition and measured ...				ACS Med Chem Lett 9: 662-666 (2018) Article DOI: 10.1021/acsmedchemlett.8b00109 BindingDB Entry DOI: 10.7270/Q2F47RPR
					More data for this Ligand-Target Pair
Pancreatic triacylglycerol lipase (Homo sapiens (Human))	BDBM50367145 (CHEMBL4173252) Show SMILES [H][C@@]12CCC(=C)C(C\C=C(/CC(=O)OCc3cn(Cc4ccc(F)cc4)nn3)C=O)[C@@]1(C)CCCC2(C)C |r| Show InChI InChI=1S/C30H38FN3O3/c1-21-6-13-27-29(2,3)14-5-15-30(27,4)26(21)12-9-23(19-35)16-28(36)37-20-25-18-34(33-32-25)17-22-7-10-24(31)11-8-22/h7-11,18-19,26-27H,1,5-6,12-17,20H2,2-4H3/b23-9+/t26?,27-,30+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
CSIR - National Institute for Interdisciplinary Science and Technology (CSIR-NIIST) Curated by ChEMBL					Assay Description Inhibition of human pancreatic lipase using emulsified olive oil as substrate pretreated with substrate for 5 mins followed by enzyme addition and me...				ACS Med Chem Lett 9: 662-666 (2018) Article DOI: 10.1021/acsmedchemlett.8b00109 BindingDB Entry DOI: 10.7270/Q2F47RPR
					More data for this Ligand-Target Pair
Pancreatic triacylglycerol lipase (Homo sapiens (Human))	BDBM50367138 (CHEMBL4160519) Show SMILES [H][C@@]12CCC(=C)C(C\C=C(/CC(=O)OCc3cn(Cc4ccc(Cl)cc4)nn3)C=O)[C@@]1(C)CCCC2(C)C |r| Show InChI InChI=1S/C30H38ClN3O3/c1-21-6-13-27-29(2,3)14-5-15-30(27,4)26(21)12-9-23(19-35)16-28(36)37-20-25-18-34(33-32-25)17-22-7-10-24(31)11-8-22/h7-11,18-19,26-27H,1,5-6,12-17,20H2,2-4H3/b23-9+/t26?,27-,30+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.25E+3	n/a	n/a	n/a	n/a	n/a	n/a
CSIR - National Institute for Interdisciplinary Science and Technology (CSIR-NIIST) Curated by ChEMBL					Assay Description Inhibition of human pancreatic lipase using emulsified olive oil as substrate pretreated with substrate for 5 mins followed by enzyme addition and me...				ACS Med Chem Lett 9: 662-666 (2018) Article DOI: 10.1021/acsmedchemlett.8b00109 BindingDB Entry DOI: 10.7270/Q2F47RPR
					More data for this Ligand-Target Pair
Pancreatic triacylglycerol lipase (Homo sapiens (Human))	BDBM50367133 (CHEMBL4164998) Show SMILES [H][C@@]12CCC(=C)C(C\C=C(/CC(=O)OCc3cn(Cc4ccc(SC)cc4)nn3)C=O)[C@@]1(C)CCCC2(C)C |r| Show InChI InChI=1S/C31H41N3O3S/c1-22-7-14-28-30(2,3)15-6-16-31(28,4)27(22)13-10-24(20-35)17-29(36)37-21-25-19-34(33-32-25)18-23-8-11-26(38-5)12-9-23/h8-12,19-20,27-28H,1,6-7,13-18,21H2,2-5H3/b24-10+/t27?,28-,31+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.65E+3	n/a	n/a	n/a	n/a	n/a	n/a
CSIR - National Institute for Interdisciplinary Science and Technology (CSIR-NIIST) Curated by ChEMBL					Assay Description Inhibition of human pancreatic lipase using emulsified olive oil as substrate pretreated with substrate for 5 mins followed by enzyme addition and me...				ACS Med Chem Lett 9: 662-666 (2018) Article DOI: 10.1021/acsmedchemlett.8b00109 BindingDB Entry DOI: 10.7270/Q2F47RPR
					More data for this Ligand-Target Pair
Pancreatic triacylglycerol lipase (Homo sapiens (Human))	BDBM50367134 (CHEMBL4167341) Show SMILES [H][C@@]12CCC(=C)C(C\C=C(/CC(=O)OCc3cn(Cc4ccc(OC)cc4)nn3)C=O)[C@@]1(C)CCCC2(C)C |r| Show InChI InChI=1S/C31H41N3O4/c1-22-7-14-28-30(2,3)15-6-16-31(28,4)27(22)13-10-24(20-35)17-29(36)38-21-25-19-34(33-32-25)18-23-8-11-26(37-5)12-9-23/h8-12,19-20,27-28H,1,6-7,13-18,21H2,2-5H3/b24-10+/t27?,28-,31+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.87E+3	n/a	n/a	n/a	n/a	n/a	n/a
CSIR - National Institute for Interdisciplinary Science and Technology (CSIR-NIIST) Curated by ChEMBL					Assay Description Inhibition of human pancreatic lipase using emulsified olive oil as substrate pretreated with substrate for 5 mins followed by enzyme addition and me...				ACS Med Chem Lett 9: 662-666 (2018) Article DOI: 10.1021/acsmedchemlett.8b00109 BindingDB Entry DOI: 10.7270/Q2F47RPR
					More data for this Ligand-Target Pair
Pancreatic triacylglycerol lipase (Homo sapiens (Human))	BDBM50367211 (CHEMBL4165339) Show SMILES [H][C@@]12CCC(=C)C(C\C=C(/CC(=O)OCc3cn(Cc4ccc(cc4)[N+]([O-])=O)nn3)C=O)[C@@]1(C)CCCC2(C)C |r| Show InChI InChI=1S/C30H38N4O5/c1-21-6-13-27-29(2,3)14-5-15-30(27,4)26(21)12-9-23(19-35)16-28(36)39-20-24-18-33(32-31-24)17-22-7-10-25(11-8-22)34(37)38/h7-11,18-19,26-27H,1,5-6,12-17,20H2,2-4H3/b23-9+/t26?,27-,30+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.01E+3	n/a	n/a	n/a	n/a	n/a	n/a
CSIR - National Institute for Interdisciplinary Science and Technology (CSIR-NIIST) Curated by ChEMBL					Assay Description Inhibition of human pancreatic lipase using emulsified olive oil as substrate pretreated with substrate for 5 mins followed by enzyme addition and me...				ACS Med Chem Lett 9: 662-666 (2018) Article DOI: 10.1021/acsmedchemlett.8b00109 BindingDB Entry DOI: 10.7270/Q2F47RPR
					More data for this Ligand-Target Pair
Pancreatic triacylglycerol lipase (Homo sapiens (Human))	BDBM50367212 (CHEMBL4168413) Show SMILES [H][C@@]12CCC(=C)C(C\C=C(/CC(=O)OCc3cn(Cc4ccc(cc4)C(C)(C)C)nn3)C=O)[C@@]1(C)CCCC2(C)C |r| Show InChI InChI=1S/C34H47N3O3/c1-24-9-16-30-33(5,6)17-8-18-34(30,7)29(24)15-12-26(22-38)19-31(39)40-23-28-21-37(36-35-28)20-25-10-13-27(14-11-25)32(2,3)4/h10-14,21-22,29-30H,1,8-9,15-20,23H2,2-7H3/b26-12+/t29?,30-,34+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.28E+3	n/a	n/a	n/a	n/a	n/a	n/a
CSIR - National Institute for Interdisciplinary Science and Technology (CSIR-NIIST) Curated by ChEMBL					Assay Description Inhibition of human pancreatic lipase using emulsified olive oil as substrate pretreated with substrate for 5 mins followed by enzyme addition and me...				ACS Med Chem Lett 9: 662-666 (2018) Article DOI: 10.1021/acsmedchemlett.8b00109 BindingDB Entry DOI: 10.7270/Q2F47RPR
					More data for this Ligand-Target Pair
Pancreatic triacylglycerol lipase (Homo sapiens (Human))	BDBM50367214 (CHEMBL4163899) Show SMILES [H][C@@]12CCC(=C)C(C\C=C(/CC(=O)OCc3cn(Cc4ccc(F)cc4Br)nn3)C=O)[C@@]1(C)CCCC2(C)C |r| Show InChI InChI=1S/C30H37BrFN3O3/c1-20-6-11-27-29(2,3)12-5-13-30(27,4)25(20)10-7-21(18-36)14-28(37)38-19-24-17-35(34-33-24)16-22-8-9-23(32)15-26(22)31/h7-9,15,17-18,25,27H,1,5-6,10-14,16,19H2,2-4H3/b21-7+/t25?,27-,30+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.31E+3	n/a	n/a	n/a	n/a	n/a	n/a
CSIR - National Institute for Interdisciplinary Science and Technology (CSIR-NIIST) Curated by ChEMBL					Assay Description Inhibition of human pancreatic lipase using emulsified olive oil as substrate pretreated with substrate for 5 mins followed by enzyme addition and me...				ACS Med Chem Lett 9: 662-666 (2018) Article DOI: 10.1021/acsmedchemlett.8b00109 BindingDB Entry DOI: 10.7270/Q2F47RPR
					More data for this Ligand-Target Pair
Pancreatic triacylglycerol lipase (Sus scrofa (Pig))	BDBM50367213 (CHEMBL4175223) Show SMILES [H][C@@]12CCC(=C)C(C\C=C(/CC(=O)OCc3cn(Cc4cc(OC)ccc4Br)nn3)C=O)[C@@]1(C)CCCC2(C)C |r| Show InChI InChI=1S/C31H40BrN3O4/c1-21-7-12-28-30(2,3)13-6-14-31(28,4)26(21)10-8-22(19-36)15-29(37)39-20-24-18-35(34-33-24)17-23-16-25(38-5)9-11-27(23)32/h8-9,11,16,18-19,26,28H,1,6-7,10,12-15,17,20H2,2-5H3/b22-8+/t26?,28-,31+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.43E+3	n/a	n/a	n/a	n/a	n/a	n/a
CSIR - National Institute for Interdisciplinary Science and Technology (CSIR-NIIST) Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic lipase using p-nitrophenyl butyrate as substrate pretreated for 15 mins followed by substrate addition and measured ...				ACS Med Chem Lett 9: 662-666 (2018) Article DOI: 10.1021/acsmedchemlett.8b00109 BindingDB Entry DOI: 10.7270/Q2F47RPR
					More data for this Ligand-Target Pair
Pancreatic triacylglycerol lipase (Sus scrofa (Pig))	BDBM50367143 (CHEMBL4168757) Show SMILES [H][C@@]12CCC(=C)C(C\C=C(/CC(=O)OCc3cn(Cc4ccccc4)nn3)C=O)[C@@]1(C)CCCC2(C)C |r| Show InChI InChI=1S/C30H39N3O3/c1-22-11-14-27-29(2,3)15-8-16-30(27,4)26(22)13-12-24(20-34)17-28(35)36-21-25-19-33(32-31-25)18-23-9-6-5-7-10-23/h5-7,9-10,12,19-20,26-27H,1,8,11,13-18,21H2,2-4H3/b24-12+/t26?,27-,30+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.35E+3	n/a	n/a	n/a	n/a	n/a	n/a
CSIR - National Institute for Interdisciplinary Science and Technology (CSIR-NIIST) Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic lipase using p-nitrophenyl butyrate as substrate pretreated for 15 mins followed by substrate addition and measured ...				ACS Med Chem Lett 9: 662-666 (2018) Article DOI: 10.1021/acsmedchemlett.8b00109 BindingDB Entry DOI: 10.7270/Q2F47RPR
					More data for this Ligand-Target Pair
Pancreatic triacylglycerol lipase (Sus scrofa (Pig))	BDBM50367135 (CHEMBL4160094) Show SMILES [H][C@@]12CCC(=C)C(C\C=C(/CC(=O)OCc3cn(CC(=O)c4ccccc4)nn3)C=O)[C@@]1(C)CCCC2(C)C |r| Show InChI InChI=1S/C31H39N3O4/c1-22-11-14-28-30(2,3)15-8-16-31(28,4)26(22)13-12-23(20-35)17-29(37)38-21-25-18-34(33-32-25)19-27(36)24-9-6-5-7-10-24/h5-7,9-10,12,18,20,26,28H,1,8,11,13-17,19,21H2,2-4H3/b23-12+/t26?,28-,31+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.22E+3	n/a	n/a	n/a	n/a	n/a	n/a
CSIR - National Institute for Interdisciplinary Science and Technology (CSIR-NIIST) Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic lipase using p-nitrophenyl butyrate as substrate pretreated for 15 mins followed by substrate addition and measured ...				ACS Med Chem Lett 9: 662-666 (2018) Article DOI: 10.1021/acsmedchemlett.8b00109 BindingDB Entry DOI: 10.7270/Q2F47RPR
					More data for this Ligand-Target Pair
Pancreatic triacylglycerol lipase (Homo sapiens (Human))	BDBM50367213 (CHEMBL4175223) Show SMILES [H][C@@]12CCC(=C)C(C\C=C(/CC(=O)OCc3cn(Cc4cc(OC)ccc4Br)nn3)C=O)[C@@]1(C)CCCC2(C)C |r| Show InChI InChI=1S/C31H40BrN3O4/c1-21-7-12-28-30(2,3)13-6-14-31(28,4)26(21)10-8-22(19-36)15-29(37)39-20-24-18-35(34-33-24)17-23-16-25(38-5)9-11-27(23)32/h8-9,11,16,18-19,26,28H,1,6-7,10,12-15,17,20H2,2-5H3/b22-8+/t26?,28-,31+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
CSIR - National Institute for Interdisciplinary Science and Technology (CSIR-NIIST) Curated by ChEMBL					Assay Description Inhibition of human pancreatic lipase using emulsified olive oil as substrate pretreated with substrate for 5 mins followed by enzyme addition and me...				ACS Med Chem Lett 9: 662-666 (2018) Article DOI: 10.1021/acsmedchemlett.8b00109 BindingDB Entry DOI: 10.7270/Q2F47RPR
					More data for this Ligand-Target Pair
Pancreatic triacylglycerol lipase (Homo sapiens (Human))	BDBM50367216 (CHEMBL4176621) Show SMILES [H][C@@]12CCC(=C)C(C\C=C(/CC(=O)OCC#C)C=O)[C@@]1(C)CCCC2(C)C |r| Show InChI InChI=1S/C23H32O3/c1-6-14-26-21(25)15-18(16-24)9-10-19-17(2)8-11-20-22(3,4)12-7-13-23(19,20)5/h1,9,16,19-20H,2,7-8,10-15H2,3-5H3/b18-9+/t19?,20-,23+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.38E+3	n/a	n/a	n/a	n/a	n/a	n/a
CSIR - National Institute for Interdisciplinary Science and Technology (CSIR-NIIST) Curated by ChEMBL					Assay Description Inhibition of human pancreatic lipase using emulsified olive oil as substrate pretreated with substrate for 5 mins followed by enzyme addition and me...				ACS Med Chem Lett 9: 662-666 (2018) Article DOI: 10.1021/acsmedchemlett.8b00109 BindingDB Entry DOI: 10.7270/Q2F47RPR
					More data for this Ligand-Target Pair
Pancreatic triacylglycerol lipase (Homo sapiens (Human))	BDBM50367135 (CHEMBL4160094) Show SMILES [H][C@@]12CCC(=C)C(C\C=C(/CC(=O)OCc3cn(CC(=O)c4ccccc4)nn3)C=O)[C@@]1(C)CCCC2(C)C |r| Show InChI InChI=1S/C31H39N3O4/c1-22-11-14-28-30(2,3)15-8-16-31(28,4)26(22)13-12-23(20-35)17-29(37)38-21-25-18-34(33-32-25)19-27(36)24-9-6-5-7-10-24/h5-7,9-10,12,18,20,26,28H,1,8,11,13-17,19,21H2,2-4H3/b23-12+/t26?,28-,31+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.82E+3	n/a	n/a	n/a	n/a	n/a	n/a
CSIR - National Institute for Interdisciplinary Science and Technology (CSIR-NIIST) Curated by ChEMBL					Assay Description Inhibition of human pancreatic lipase using emulsified olive oil as substrate pretreated with substrate for 5 mins followed by enzyme addition and me...				ACS Med Chem Lett 9: 662-666 (2018) Article DOI: 10.1021/acsmedchemlett.8b00109 BindingDB Entry DOI: 10.7270/Q2F47RPR
					More data for this Ligand-Target Pair
Pancreatic triacylglycerol lipase (Sus scrofa (Pig))	BDBM50367216 (CHEMBL4176621) Show SMILES [H][C@@]12CCC(=C)C(C\C=C(/CC(=O)OCC#C)C=O)[C@@]1(C)CCCC2(C)C |r| Show InChI InChI=1S/C23H32O3/c1-6-14-26-21(25)15-18(16-24)9-10-19-17(2)8-11-20-22(3,4)12-7-13-23(19,20)5/h1,9,16,19-20H,2,7-8,10-15H2,3-5H3/b18-9+/t19?,20-,23+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.64E+3	n/a	n/a	n/a	n/a	n/a	n/a
CSIR - National Institute for Interdisciplinary Science and Technology (CSIR-NIIST) Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic lipase using p-nitrophenyl butyrate as substrate pretreated for 15 mins followed by substrate addition and measured ...				ACS Med Chem Lett 9: 662-666 (2018) Article DOI: 10.1021/acsmedchemlett.8b00109 BindingDB Entry DOI: 10.7270/Q2F47RPR
					More data for this Ligand-Target Pair
Pancreatic triacylglycerol lipase (Homo sapiens (Human))	BDBM50367143 (CHEMBL4168757) Show SMILES [H][C@@]12CCC(=C)C(C\C=C(/CC(=O)OCc3cn(Cc4ccccc4)nn3)C=O)[C@@]1(C)CCCC2(C)C |r| Show InChI InChI=1S/C30H39N3O3/c1-22-11-14-27-29(2,3)15-8-16-30(27,4)26(22)13-12-24(20-34)17-28(35)36-21-25-19-33(32-31-25)18-23-9-6-5-7-10-23/h5-7,9-10,12,19-20,26-27H,1,8,11,13-18,21H2,2-4H3/b24-12+/t26?,27-,30+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.15E+3	n/a	n/a	n/a	n/a	n/a	n/a
CSIR - National Institute for Interdisciplinary Science and Technology (CSIR-NIIST) Curated by ChEMBL					Assay Description Inhibition of human pancreatic lipase using emulsified olive oil as substrate pretreated with substrate for 5 mins followed by enzyme addition and me...				ACS Med Chem Lett 9: 662-666 (2018) Article DOI: 10.1021/acsmedchemlett.8b00109 BindingDB Entry DOI: 10.7270/Q2F47RPR
					More data for this Ligand-Target Pair
Pancreatic triacylglycerol lipase (Sus scrofa (Pig))	BDBM50367136 (CHEMBL4172103) Show SMILES [H][C@@]12CCC(=C)C(C\C=C(/CC(O)=O)C=O)[C@@]1(C)CCCC2(C)C |r| Show InChI InChI=1S/C20H30O3/c1-14-6-9-17-19(2,3)10-5-11-20(17,4)16(14)8-7-15(13-21)12-18(22)23/h7,13,16-17H,1,5-6,8-12H2,2-4H3,(H,22,23)/b15-7+/t16?,17-,20+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.03E+4	n/a	n/a	n/a	n/a	n/a	n/a
CSIR - National Institute for Interdisciplinary Science and Technology (CSIR-NIIST) Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic lipase using p-nitrophenyl butyrate as substrate pretreated for 15 mins followed by substrate addition and measured ...				ACS Med Chem Lett 9: 662-666 (2018) Article DOI: 10.1021/acsmedchemlett.8b00109 BindingDB Entry DOI: 10.7270/Q2F47RPR
					More data for this Ligand-Target Pair
Pancreatic triacylglycerol lipase (Sus scrofa (Pig))	BDBM50367215 (CHEMBL4170734) Show SMILES [H][C@@]12CCC(=C)C(C\C=C(/CC(=O)OCc3cn(Cc4ccccc4-c4ccccc4)nn3)C=O)[C@@]1(C)CCCC2(C)C |r| Show InChI InChI=1S/C36H43N3O3/c1-26-15-18-33-35(2,3)19-10-20-36(33,4)32(26)17-16-27(24-40)21-34(41)42-25-30-23-39(38-37-30)22-29-13-8-9-14-31(29)28-11-6-5-7-12-28/h5-9,11-14,16,23-24,32-33H,1,10,15,17-22,25H2,2-4H3/b27-16+/t32?,33-,36+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.04E+4	n/a	n/a	n/a	n/a	n/a	n/a
CSIR - National Institute for Interdisciplinary Science and Technology (CSIR-NIIST) Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic lipase using p-nitrophenyl butyrate as substrate pretreated for 15 mins followed by substrate addition and measured ...				ACS Med Chem Lett 9: 662-666 (2018) Article DOI: 10.1021/acsmedchemlett.8b00109 BindingDB Entry DOI: 10.7270/Q2F47RPR
					More data for this Ligand-Target Pair
Pancreatic triacylglycerol lipase (Homo sapiens (Human))	BDBM50367136 (CHEMBL4172103) Show SMILES [H][C@@]12CCC(=C)C(C\C=C(/CC(O)=O)C=O)[C@@]1(C)CCCC2(C)C |r| Show InChI InChI=1S/C20H30O3/c1-14-6-9-17-19(2,3)10-5-11-20(17,4)16(14)8-7-15(13-21)12-18(22)23/h7,13,16-17H,1,5-6,8-12H2,2-4H3,(H,22,23)/b15-7+/t16?,17-,20+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.18E+4	n/a	n/a	n/a	n/a	n/a	n/a
CSIR - National Institute for Interdisciplinary Science and Technology (CSIR-NIIST) Curated by ChEMBL					Assay Description Inhibition of human pancreatic lipase using emulsified olive oil as substrate pretreated with substrate for 5 mins followed by enzyme addition and me...				ACS Med Chem Lett 9: 662-666 (2018) Article DOI: 10.1021/acsmedchemlett.8b00109 BindingDB Entry DOI: 10.7270/Q2F47RPR
					More data for this Ligand-Target Pair
Pancreatic triacylglycerol lipase (Homo sapiens (Human))	BDBM50367215 (CHEMBL4170734) Show SMILES [H][C@@]12CCC(=C)C(C\C=C(/CC(=O)OCc3cn(Cc4ccccc4-c4ccccc4)nn3)C=O)[C@@]1(C)CCCC2(C)C |r| Show InChI InChI=1S/C36H43N3O3/c1-26-15-18-33-35(2,3)19-10-20-36(33,4)32(26)17-16-27(24-40)21-34(41)42-25-30-23-39(38-37-30)22-29-13-8-9-14-31(29)28-11-6-5-7-12-28/h5-9,11-14,16,23-24,32-33H,1,10,15,17-22,25H2,2-4H3/b27-16+/t32?,33-,36+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.35E+4	n/a	n/a	n/a	n/a	n/a	n/a
CSIR - National Institute for Interdisciplinary Science and Technology (CSIR-NIIST) Curated by ChEMBL					Assay Description Inhibition of human pancreatic lipase using emulsified olive oil as substrate pretreated with substrate for 5 mins followed by enzyme addition and me...				ACS Med Chem Lett 9: 662-666 (2018) Article DOI: 10.1021/acsmedchemlett.8b00109 BindingDB Entry DOI: 10.7270/Q2F47RPR
					More data for this Ligand-Target Pair
Pancreatic triacylglycerol lipase (Homo sapiens (Human))	BDBM50367142 (CHEMBL4161505) Show SMILES [H][C@@]12CCC(=C)C(C\C=C(/CC=O)C=O)[C@@]1(C)CCCC2(C)C |r| Show InChI InChI=1S/C20H30O2/c1-15-6-9-18-19(2,3)11-5-12-20(18,4)17(15)8-7-16(14-22)10-13-21/h7,13-14,17-18H,1,5-6,8-12H2,2-4H3/b16-7+/t17?,18-,20+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.45E+4	n/a	n/a	n/a	n/a	n/a	n/a
CSIR - National Institute for Interdisciplinary Science and Technology (CSIR-NIIST) Curated by ChEMBL					Assay Description Inhibition of human pancreatic lipase using emulsified olive oil as substrate pretreated with substrate for 5 mins followed by enzyme addition and me...				ACS Med Chem Lett 9: 662-666 (2018) Article DOI: 10.1021/acsmedchemlett.8b00109 BindingDB Entry DOI: 10.7270/Q2F47RPR
					More data for this Ligand-Target Pair
Pancreatic triacylglycerol lipase (Sus scrofa (Pig))	BDBM50367142 (CHEMBL4161505) Show SMILES [H][C@@]12CCC(=C)C(C\C=C(/CC=O)C=O)[C@@]1(C)CCCC2(C)C |r| Show InChI InChI=1S/C20H30O2/c1-15-6-9-18-19(2,3)11-5-12-20(18,4)17(15)8-7-16(14-22)10-13-21/h7,13-14,17-18H,1,5-6,8-12H2,2-4H3/b16-7+/t17?,18-,20+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.46E+4	n/a	n/a	n/a	n/a	n/a	n/a
CSIR - National Institute for Interdisciplinary Science and Technology (CSIR-NIIST) Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic lipase using p-nitrophenyl butyrate as substrate pretreated for 15 mins followed by substrate addition and measured ...				ACS Med Chem Lett 9: 662-666 (2018) Article DOI: 10.1021/acsmedchemlett.8b00109 BindingDB Entry DOI: 10.7270/Q2F47RPR
					More data for this Ligand-Target Pair