Compile Data Set for Download or QSAR

Found 126 hits with Last Name = 'messmer' and Initial = 'd'   

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
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50013729 (CHEMBL3264919) Show SMILES CCn1c(CCCc2ccc(OC(C)(C)C(=O)NS(=O)(=O)c3ccccc3)cc2)nn(Cc2ccc(cc2)C(C)(C)C)c1=O Show InChI InChI=1S/C34H42N4O5S/c1-7-37-30(35-38(32(37)40)24-26-16-20-27(21-17-26)33(2,3)4)15-11-12-25-18-22-28(23-19-25)43-34(5,6)31(39)36-44(41,42)29-13-9-8-10-14-29/h8-10,13-14,16-23H,7,11-12,15,24H2,1-6H3,(H,36,39)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.70	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at human PPAR-alpha assessed as inhibition of GW7647-induced effect after overnight incubation by cell-based luciferase reporter ...				Bioorg Med Chem Lett 24: 2267-72 (2014) Article DOI: 10.1016/j.bmcl.2014.03.090 BindingDB Entry DOI: 10.7270/Q2GX4D33
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50013730 (CHEMBL3264920) Show SMILES CCn1c(CCCc2ccc(OC(C)(C)C(=O)NS(=O)(=O)c3ccc(C)cc3)cc2)nn(Cc2ccc(cc2)C(C)(C)C)c1=O Show InChI InChI=1S/C35H44N4O5S/c1-8-38-31(36-39(33(38)41)24-27-14-18-28(19-15-27)34(3,4)5)11-9-10-26-16-20-29(21-17-26)44-35(6,7)32(40)37-45(42,43)30-22-12-25(2)13-23-30/h12-23H,8-11,24H2,1-7H3,(H,37,40)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.80	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at human PPAR-alpha assessed as inhibition of GW7647-induced effect after overnight incubation by cell-based luciferase reporter ...				Bioorg Med Chem Lett 24: 2267-72 (2014) Article DOI: 10.1016/j.bmcl.2014.03.090 BindingDB Entry DOI: 10.7270/Q2GX4D33
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50013734 (CHEMBL3264924) Show SMILES CCn1c(CCCc2ccc(OC(C)(C)C(=O)NS(=O)(=O)C3CCCCC3)cc2)nn(Cc2ccc(cc2)C(C)(C)C)c1=O Show InChI InChI=1S/C34H48N4O5S/c1-7-37-30(35-38(32(37)40)24-26-16-20-27(21-17-26)33(2,3)4)15-11-12-25-18-22-28(23-19-25)43-34(5,6)31(39)36-44(41,42)29-13-9-8-10-14-29/h16-23,29H,7-15,24H2,1-6H3,(H,36,39)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at human PPAR-alpha assessed as inhibition of GW7647-induced effect after overnight incubation by cell-based luciferase reporter ...				Bioorg Med Chem Lett 24: 2267-72 (2014) Article DOI: 10.1016/j.bmcl.2014.03.090 BindingDB Entry DOI: 10.7270/Q2GX4D33
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50013735 (CHEMBL3264925) Show SMILES CCn1c(CCCc2ccc(OC(C)(C)C(=O)NS(=O)(=O)C3CCCC3)cc2)nn(Cc2ccc(cc2)C(C)(C)C)c1=O Show InChI InChI=1S/C33H46N4O5S/c1-7-36-29(34-37(31(36)39)23-25-15-19-26(20-16-25)32(2,3)4)14-10-11-24-17-21-27(22-18-24)42-33(5,6)30(38)35-43(40,41)28-12-8-9-13-28/h15-22,28H,7-14,23H2,1-6H3,(H,35,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.60	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at human PPAR-alpha assessed as inhibition of GW7647-induced effect after overnight incubation by cell-based luciferase reporter ...				Bioorg Med Chem Lett 24: 2267-72 (2014) Article DOI: 10.1016/j.bmcl.2014.03.090 BindingDB Entry DOI: 10.7270/Q2GX4D33
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50013736 (CHEMBL3264926) Show SMILES CCn1c(CCCc2ccc(OC(C)(C)C(=O)NS(=O)(=O)C3CC3)cc2)nn(Cc2ccc(cc2)C(C)(C)C)c1=O Show InChI InChI=1S/C31H42N4O5S/c1-7-34-27(32-35(29(34)37)21-23-11-15-24(16-12-23)30(2,3)4)10-8-9-22-13-17-25(18-14-22)40-31(5,6)28(36)33-41(38,39)26-19-20-26/h11-18,26H,7-10,19-21H2,1-6H3,(H,33,36)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6.60	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at human PPAR-alpha assessed as inhibition of GW7647-induced effect after overnight incubation by cell-based luciferase reporter ...				Bioorg Med Chem Lett 24: 2267-72 (2014) Article DOI: 10.1016/j.bmcl.2014.03.090 BindingDB Entry DOI: 10.7270/Q2GX4D33
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50013731 (CHEMBL3264921) Show SMILES CCn1c(CCCc2ccc(OC(C)(C)C(=O)NS(=O)(=O)c3ccc(cc3)C(C)C)cc2)nn(Cc2ccc(cc2)C(C)(C)C)c1=O Show InChI InChI=1S/C37H48N4O5S/c1-9-40-33(38-41(35(40)43)25-28-13-19-30(20-14-28)36(4,5)6)12-10-11-27-15-21-31(22-16-27)46-37(7,8)34(42)39-47(44,45)32-23-17-29(18-24-32)26(2)3/h13-24,26H,9-12,25H2,1-8H3,(H,39,42)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at human PPAR-alpha assessed as inhibition of GW7647-induced effect after overnight incubation by cell-based luciferase reporter ...				Bioorg Med Chem Lett 24: 2267-72 (2014) Article DOI: 10.1016/j.bmcl.2014.03.090 BindingDB Entry DOI: 10.7270/Q2GX4D33
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50508126 (CHEMBL4457564) Show SMILES CCOc1ccc(cc1CC(O)=O)-c1ccc(CCCc2nn(-c3ccc(cc3)C(F)(F)F)c(=O)n2-c2ccc(cc2)C(F)(F)F)cc1 Show InChI InChI=1S/C35H29F6N3O4/c1-2-48-30-19-10-24(20-25(30)21-32(45)46)23-8-6-22(7-9-23)4-3-5-31-42-44(29-17-13-27(14-18-29)35(39,40)41)33(47)43(31)28-15-11-26(12-16-28)34(36,37)38/h6-20H,2-5,21H2,1H3,(H,45,46)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARalpha assessed as inhibition of GW7647-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50508137 (CHEMBL4437146) Show SMILES COc1ccc(nc1NS(=O)(=O)c1ccccc1)-c1ccc(OCc2nn(-c3ccc(cc3)C(F)(F)F)c(=O)n2-c2ccccc2F)cc1 |(67.94,-13.52,;66.62,-14.31,;65.28,-13.55,;65.25,-12.01,;63.91,-11.26,;62.6,-12.04,;62.61,-13.58,;63.95,-14.34,;63.96,-15.88,;65.3,-16.63,;66.63,-15.85,;66.64,-17.39,;65.32,-18.17,;63.99,-18.95,;64.01,-20.49,;65.35,-21.25,;66.68,-20.45,;66.66,-18.92,;61.26,-11.28,;59.93,-12.07,;58.59,-11.31,;58.58,-9.77,;57.24,-9.01,;55.91,-9.79,;54.57,-9.04,;54.09,-7.57,;52.55,-7.58,;51.64,-6.33,;52.27,-4.93,;51.36,-3.69,;49.83,-3.85,;49.21,-5.27,;50.12,-6.51,;48.92,-2.61,;49.54,-1.2,;47.39,-2.78,;47.82,-1.51,;52.08,-9.04,;50.62,-9.53,;53.33,-9.94,;53.34,-11.48,;54.67,-12.24,;54.68,-13.79,;53.34,-14.57,;52.01,-13.79,;52.01,-12.25,;50.68,-11.48,;59.9,-8.99,;61.24,-9.74,)| Show InChI InChI=1S/C34H25F4N5O5S/c1-47-30-20-19-28(39-32(30)41-49(45,46)26-7-3-2-4-8-26)22-11-17-25(18-12-22)48-21-31-40-43(24-15-13-23(14-16-24)34(36,37)38)33(44)42(31)29-10-6-5-9-27(29)35/h2-20H,21H2,1H3,(H,39,41)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARalpha assessed as inhibition of GW7647-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50508159 (CHEMBL4529735) Show SMILES CCOc1ccc(cc1CC(O)=O)-c1ccc(CCCc2nn(-c3ccc(cc3)C(F)(F)F)c(=O)n2-c2ccccc2)cc1 Show InChI InChI=1S/C34H30F3N3O4/c1-2-44-30-20-15-25(21-26(30)22-32(41)42)24-13-11-23(12-14-24)7-6-10-31-38-40(29-18-16-27(17-19-29)34(35,36)37)33(43)39(31)28-8-4-3-5-9-28/h3-5,8-9,11-21H,2,6-7,10,22H2,1H3,(H,41,42)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARdelta assessed as inhibition of GW0742-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50508153 (CHEMBL4549922) Show SMILES CCOc1ccc(cc1CC(O)=O)-c1ccc(CCCc2nn(-c3ccc(OC(F)(F)F)cc3)c(=O)n2-c2ccccc2F)cc1 |(80.09,-3.25,;78.76,-4.04,;77.42,-3.28,;76.09,-4.07,;74.74,-3.31,;73.42,-4.1,;73.44,-5.62,;74.78,-6.39,;76.11,-5.61,;77.45,-6.37,;77.46,-7.91,;76.14,-8.69,;78.8,-8.66,;72.12,-6.41,;72.13,-7.95,;70.8,-8.73,;69.46,-7.97,;68.14,-8.75,;66.8,-7.99,;65.47,-8.77,;64.13,-8.01,;63.65,-6.55,;62.11,-6.55,;61.33,-5.22,;62.09,-3.89,;61.31,-2.56,;59.77,-2.57,;58.99,-1.25,;57.45,-1.26,;56.66,.08,;56.69,-2.6,;55.9,-1.25,;59.01,-3.92,;59.8,-5.24,;61.64,-8.02,;60.18,-8.5,;62.89,-8.91,;62.9,-10.45,;64.23,-11.22,;64.24,-12.77,;62.9,-13.54,;61.57,-12.77,;61.57,-11.22,;60.23,-10.45,;69.45,-6.43,;70.77,-5.65,)| Show InChI InChI=1S/C34H29F4N3O5/c1-2-45-30-19-14-24(20-25(30)21-32(42)43)23-12-10-22(11-13-23)6-5-9-31-39-41(26-15-17-27(18-16-26)46-34(36,37)38)33(44)40(31)29-8-4-3-7-28(29)35/h3-4,7-8,10-20H,2,5-6,9,21H2,1H3,(H,42,43)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARalpha assessed as inhibition of GW7647-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50508144 (CHEMBL4545223) Show SMILES CCOc1ccc(cc1CC(O)=O)-c1ccc(CCCc2nn(-c3ccc(cc3)C(F)(F)F)c(=O)n2-c2ccc(cc2)C(C)(C)C)cc1 Show InChI InChI=1S/C38H38F3N3O4/c1-5-48-33-22-13-27(23-28(33)24-35(45)46)26-11-9-25(10-12-26)7-6-8-34-42-44(32-20-16-30(17-21-32)38(39,40)41)36(47)43(34)31-18-14-29(15-19-31)37(2,3)4/h9-23H,5-8,24H2,1-4H3,(H,45,46)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARalpha assessed as inhibition of GW7647-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50013741 (CHEMBL3264931) Show SMILES CCn1c(CCCc2ccc(cc2)-c2ccc(NS(=O)(=O)c3ccccc3)cc2)nn(Cc2ccc(cc2)C(C)(C)C)c1=O Show InChI InChI=1S/C36H40N4O3S/c1-5-39-34(37-40(35(39)41)26-28-16-22-31(23-17-28)36(2,3)4)13-9-10-27-14-18-29(19-15-27)30-20-24-32(25-21-30)38-44(42,43)33-11-7-6-8-12-33/h6-8,11-12,14-25,38H,5,9-10,13,26H2,1-4H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at human PPAR-alpha assessed as inhibition of GW7647-induced effect after overnight incubation by cell-based luciferase reporter ...				Bioorg Med Chem Lett 24: 2267-72 (2014) Article DOI: 10.1016/j.bmcl.2014.03.090 BindingDB Entry DOI: 10.7270/Q2GX4D33
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50508159 (CHEMBL4529735) Show SMILES CCOc1ccc(cc1CC(O)=O)-c1ccc(CCCc2nn(-c3ccc(cc3)C(F)(F)F)c(=O)n2-c2ccccc2)cc1 Show InChI InChI=1S/C34H30F3N3O4/c1-2-44-30-20-15-25(21-26(30)22-32(41)42)24-13-11-23(12-14-24)7-6-10-31-38-40(29-18-16-27(17-19-29)34(35,36)37)33(43)39(31)28-8-4-3-5-9-28/h3-5,8-9,11-21H,2,6-7,10,22H2,1H3,(H,41,42)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	23	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARalpha assessed as inhibition of GW7647-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50508127 (CHEMBL4449687) Show SMILES CCOc1ccc(cc1CC(O)=O)-c1ccc(CCCc2nn(-c3ccc(cc3)C(F)(F)F)c(=O)n2-c2ccccc2F)cc1 |(50.85,-41.06,;49.52,-41.85,;48.18,-41.09,;46.86,-41.88,;45.51,-41.12,;44.19,-41.9,;44.21,-43.43,;45.54,-44.2,;46.87,-43.42,;48.21,-44.18,;48.22,-45.72,;46.9,-46.5,;49.56,-46.47,;42.88,-44.22,;42.89,-45.76,;41.57,-46.54,;40.23,-45.77,;38.9,-46.55,;37.56,-45.8,;36.23,-46.58,;34.89,-45.82,;34.41,-44.35,;32.87,-44.36,;31.96,-43.12,;32.59,-41.71,;31.68,-40.47,;30.15,-40.63,;29.53,-42.05,;30.44,-43.29,;29.24,-39.39,;29.86,-37.98,;27.71,-39.56,;28.14,-38.29,;32.4,-45.83,;30.94,-46.31,;33.65,-46.72,;33.66,-48.26,;34.99,-49.03,;35,-50.58,;33.66,-51.35,;32.33,-50.58,;32.33,-49.03,;31,-48.26,;40.21,-44.24,;41.53,-43.46,)| Show InChI InChI=1S/C34H29F4N3O4/c1-2-45-30-19-14-24(20-25(30)21-32(42)43)23-12-10-22(11-13-23)6-5-9-31-39-41(27-17-15-26(16-18-27)34(36,37)38)33(44)40(31)29-8-4-3-7-28(29)35/h3-4,7-8,10-20H,2,5-6,9,21H2,1H3,(H,42,43)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	25	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARdelta assessed as inhibition of GW0742-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50508145 (CHEMBL4450146) Show SMILES CCOc1ccc(cc1CC(O)=O)-c1ccc(CCCc2nn(-c3ccc(cc3)C(F)(F)F)c(=O)n2-c2c(F)cccc2F)cc1 |(24.36,-4.61,;23.03,-5.4,;21.69,-4.64,;20.36,-5.43,;19.01,-4.67,;17.69,-5.46,;17.71,-6.99,;19.05,-7.75,;20.38,-6.97,;21.72,-7.73,;21.73,-9.27,;20.41,-10.05,;23.07,-10.03,;16.39,-7.77,;16.4,-9.31,;15.07,-10.09,;13.73,-9.33,;12.41,-10.11,;11.07,-9.35,;9.74,-10.13,;8.4,-9.37,;7.92,-7.91,;6.38,-7.91,;5.6,-6.58,;6.36,-5.25,;5.58,-3.92,;4.04,-3.94,;3.28,-5.29,;4.07,-6.61,;3.26,-2.61,;4.01,-1.27,;1.72,-2.62,;2.47,-1.27,;5.91,-9.38,;4.45,-9.86,;7.16,-10.27,;7.17,-11.81,;8.51,-12.57,;9.84,-11.79,;8.51,-14.11,;7.17,-14.88,;5.84,-14.11,;5.84,-12.58,;4.5,-11.81,;13.72,-7.79,;15.04,-7.01,)| Show InChI InChI=1S/C34H28F5N3O4/c1-2-46-29-18-13-23(19-24(29)20-31(43)44)22-11-9-21(10-12-22)5-3-8-30-40-42(26-16-14-25(15-17-26)34(37,38)39)33(45)41(30)32-27(35)6-4-7-28(32)36/h4,6-7,9-19H,2-3,5,8,20H2,1H3,(H,43,44)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARdelta assessed as inhibition of GW0742-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50508147 (CHEMBL4530053) Show SMILES CCOc1ccc(cc1CC(O)=O)-c1ccc(CCCc2nn(-c3ccc(cc3)C(F)(F)F)c(=O)n2C2CC2)cc1 Show InChI InChI=1S/C31H30F3N3O4/c1-2-41-27-17-10-22(18-23(27)19-29(38)39)21-8-6-20(7-9-21)4-3-5-28-35-37(30(40)36(28)25-15-16-25)26-13-11-24(12-14-26)31(32,33)34/h6-14,17-18,25H,2-5,15-16,19H2,1H3,(H,38,39)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	32	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARalpha assessed as inhibition of GW7647-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50508151 (CHEMBL4449183) Show SMILES CCOc1ccc(cc1CC(O)=O)-c1ccc(CCCc2nn(-c3ccc(cc3)C(C)(C)C)c(=O)n2-c2ccccc2F)cc1 |(51.36,-4.13,;50.04,-4.92,;48.69,-4.16,;47.37,-4.95,;46.02,-4.19,;44.7,-4.98,;44.72,-6.5,;46.06,-7.27,;47.38,-6.49,;48.72,-7.25,;48.74,-8.79,;47.41,-9.57,;50.08,-9.54,;43.39,-7.29,;43.41,-8.83,;42.08,-9.61,;40.74,-8.84,;39.41,-9.62,;38.07,-8.87,;36.74,-9.65,;35.4,-8.89,;34.92,-7.42,;33.38,-7.43,;32.6,-6.1,;33.37,-4.77,;32.59,-3.44,;31.05,-3.45,;30.29,-4.8,;31.07,-6.12,;30.26,-2.13,;31.02,-.79,;28.72,-2.14,;29.48,-.79,;32.91,-8.9,;31.45,-9.38,;34.17,-9.79,;34.17,-11.33,;35.51,-12.1,;35.51,-13.65,;34.18,-14.42,;32.84,-13.65,;32.84,-12.1,;31.51,-11.33,;40.72,-7.31,;42.04,-6.53,)| Show InChI InChI=1S/C37H38FN3O4/c1-5-45-33-22-17-27(23-28(33)24-35(42)43)26-15-13-25(14-16-26)9-8-12-34-39-41(30-20-18-29(19-21-30)37(2,3)4)36(44)40(34)32-11-7-6-10-31(32)38/h6-7,10-11,13-23H,5,8-9,12,24H2,1-4H3,(H,42,43)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	33	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARalpha assessed as inhibition of GW7647-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50508126 (CHEMBL4457564) Show SMILES CCOc1ccc(cc1CC(O)=O)-c1ccc(CCCc2nn(-c3ccc(cc3)C(F)(F)F)c(=O)n2-c2ccc(cc2)C(F)(F)F)cc1 Show InChI InChI=1S/C35H29F6N3O4/c1-2-48-30-19-10-24(20-25(30)21-32(45)46)23-8-6-22(7-9-23)4-3-5-31-42-44(29-17-13-27(14-18-29)35(39,40)41)33(47)43(31)28-15-11-26(12-16-28)34(36,37)38/h6-20H,2-5,21H2,1H3,(H,45,46)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	34	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARdelta assessed as inhibition of GW0742-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50013732 (CHEMBL3264922) Show SMILES CCn1c(CCCc2ccc(OC(C)(C)C(=O)NS(=O)(=O)c3ccc(cc3)C(F)(F)F)cc2)nn(Cc2ccc(cc2)C(C)(C)C)c1=O Show InChI InChI=1S/C35H41F3N4O5S/c1-7-41-30(39-42(32(41)44)23-25-11-15-26(16-12-25)33(2,3)4)10-8-9-24-13-19-28(20-14-24)47-34(5,6)31(43)40-48(45,46)29-21-17-27(18-22-29)35(36,37)38/h11-22H,7-10,23H2,1-6H3,(H,40,43)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	34	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at human PPAR-alpha assessed as inhibition of GW7647-induced effect after overnight incubation by cell-based luciferase reporter ...				Bioorg Med Chem Lett 24: 2267-72 (2014) Article DOI: 10.1016/j.bmcl.2014.03.090 BindingDB Entry DOI: 10.7270/Q2GX4D33
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50013729 (CHEMBL3264919) Show SMILES CCn1c(CCCc2ccc(OC(C)(C)C(=O)NS(=O)(=O)c3ccccc3)cc2)nn(Cc2ccc(cc2)C(C)(C)C)c1=O Show InChI InChI=1S/C34H42N4O5S/c1-7-37-30(35-38(32(37)40)24-26-16-20-27(21-17-26)33(2,3)4)15-11-12-25-18-22-28(23-19-25)43-34(5,6)31(39)36-44(41,42)29-13-9-8-10-14-29/h8-10,13-14,16-23H,7,11-12,15,24H2,1-6H3,(H,36,39)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at human PPARalpha				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50013729 (CHEMBL3264919) Show SMILES CCn1c(CCCc2ccc(OC(C)(C)C(=O)NS(=O)(=O)c3ccccc3)cc2)nn(Cc2ccc(cc2)C(C)(C)C)c1=O Show InChI InChI=1S/C34H42N4O5S/c1-7-37-30(35-38(32(37)40)24-26-16-20-27(21-17-26)33(2,3)4)15-11-12-25-18-22-28(23-19-25)43-34(5,6)31(39)36-44(41,42)29-13-9-8-10-14-29/h8-10,13-14,16-23H,7,11-12,15,24H2,1-6H3,(H,36,39)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at human PPAR-alpha				Bioorg Med Chem Lett 24: 2267-72 (2014) Article DOI: 10.1016/j.bmcl.2014.03.090 BindingDB Entry DOI: 10.7270/Q2GX4D33
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50508143 (CHEMBL4443720) Show SMILES CCOc1ccc(cc1CC(O)=O)-c1ccc(CCCc2nn(-c3ccc(cc3)C(F)(F)F)c(=O)n2-c2ccccc2C)cc1 |(74.83,-5.42,;73.5,-6.2,;72.16,-5.45,;70.83,-6.23,;69.48,-5.47,;68.16,-6.26,;68.19,-7.79,;69.52,-8.55,;70.85,-7.77,;72.19,-8.53,;72.2,-10.07,;70.88,-10.85,;73.54,-10.83,;66.86,-8.57,;66.87,-10.11,;65.54,-10.89,;64.21,-10.13,;62.88,-10.91,;61.54,-10.15,;60.21,-10.93,;58.87,-10.17,;58.39,-8.71,;56.85,-8.71,;56.07,-7.39,;56.83,-6.05,;56.05,-4.72,;54.51,-4.74,;53.75,-6.09,;54.54,-7.41,;53.73,-3.41,;54.49,-2.07,;52.19,-3.43,;52.94,-2.07,;56.38,-10.18,;54.92,-10.66,;57.63,-11.08,;57.64,-12.62,;56.31,-13.38,;56.31,-14.91,;57.64,-15.69,;58.98,-14.91,;58.98,-13.37,;60.31,-12.59,;64.19,-8.59,;65.51,-7.81,)| Show InChI InChI=1S/C35H32F3N3O4/c1-3-45-31-20-15-26(21-27(31)22-33(42)43)25-13-11-24(12-14-25)8-6-10-32-39-41(29-18-16-28(17-19-29)35(36,37)38)34(44)40(32)30-9-5-4-7-23(30)2/h4-5,7,9,11-21H,3,6,8,10,22H2,1-2H3,(H,42,43)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARdelta assessed as inhibition of GW0742-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50013738 (CHEMBL3264928) Show SMILES CCn1c(CCCc2ccc(OC(C)(C)C(=O)NS(=O)(=O)C3=CCOC=C3)cc2)nn(Cc2ccc(cc2)C(C)(C)C)c1=O |c:25,t:21| Show InChI InChI=1S/C33H42N4O6S/c1-7-36-29(34-37(31(36)39)23-25-11-15-26(16-12-25)32(2,3)4)10-8-9-24-13-17-27(18-14-24)43-33(5,6)30(38)35-44(40,41)28-19-21-42-22-20-28/h11-21H,7-10,22-23H2,1-6H3,(H,35,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	42	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at human PPAR-alpha assessed as inhibition of GW7647-induced effect after overnight incubation by cell-based luciferase reporter ...				Bioorg Med Chem Lett 24: 2267-72 (2014) Article DOI: 10.1016/j.bmcl.2014.03.090 BindingDB Entry DOI: 10.7270/Q2GX4D33
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50508155 (CHEMBL4592038) Show SMILES CCOc1ccc(cc1CC(O)=O)-c1ccc(CCCc2nn(-c3ccc(cc3)C(F)(F)F)c(=O)n2-c2ccccn2)cc1 Show InChI InChI=1S/C33H29F3N4O4/c1-2-44-28-18-13-24(20-25(28)21-31(41)42)23-11-9-22(10-12-23)6-5-8-30-38-40(27-16-14-26(15-17-27)33(34,35)36)32(43)39(30)29-7-3-4-19-37-29/h3-4,7,9-20H,2,5-6,8,21H2,1H3,(H,41,42)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	47	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARdelta assessed as inhibition of GW0742-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50508125 (CHEMBL4533138) Show SMILES CCOc1ccc(cc1CC(O)=O)-c1ccc(CCCc2nn(-c3ccc(cc3)C(F)(F)F)c(=O)n2CC)cc1 Show InChI InChI=1S/C30H30F3N3O4/c1-3-35-27(34-36(29(35)39)25-15-13-24(14-16-25)30(31,32)33)7-5-6-20-8-10-21(11-9-20)22-12-17-26(40-4-2)23(18-22)19-28(37)38/h8-18H,3-7,19H2,1-2H3,(H,37,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	51	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARalpha assessed as inhibition of GW7647-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50508128 (CHEMBL4539262) Show SMILES CCOc1ccc(cc1CC(O)=O)-c1ccc(CCCc2nn(-c3ccc(cc3)C(F)(F)F)c(=O)n2C2CCCC2)cc1 Show InChI InChI=1S/C33H34F3N3O4/c1-2-43-29-19-14-24(20-25(29)21-31(40)41)23-12-10-22(11-13-23)6-5-9-30-37-39(32(42)38(30)27-7-3-4-8-27)28-17-15-26(16-18-28)33(34,35)36/h10-20,27H,2-9,21H2,1H3,(H,40,41)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	55	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARalpha assessed as inhibition of GW7647-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50508132 (CHEMBL4546054) Show SMILES CCOc1ccc(cc1C(O)=O)-c1ccc(CCCc2nn(-c3ccc(cc3)C(F)(F)F)c(=O)n2-c2ccccc2F)cc1 |(50.46,-23.1,;49.13,-23.88,;47.79,-23.12,;46.47,-23.91,;45.12,-23.15,;43.8,-23.94,;43.82,-25.47,;45.16,-26.23,;46.48,-25.45,;47.82,-26.21,;49.15,-25.43,;47.84,-27.75,;42.49,-26.25,;42.5,-27.79,;41.18,-28.57,;39.84,-27.81,;38.51,-28.59,;37.17,-27.83,;35.84,-28.61,;34.5,-27.85,;34.02,-26.39,;32.48,-26.39,;31.7,-25.07,;32.47,-23.73,;31.69,-22.4,;30.14,-22.42,;29.39,-23.77,;30.17,-25.09,;29.36,-21.09,;30.12,-19.75,;27.82,-21.1,;28.58,-19.75,;32.01,-27.86,;30.55,-28.34,;33.27,-28.75,;33.27,-30.29,;31.94,-31.06,;31.94,-32.59,;33.27,-33.37,;34.61,-32.59,;34.61,-31.05,;35.94,-30.27,;39.82,-26.27,;41.14,-25.49,)| Show InChI InChI=1S/C33H27F4N3O4/c1-2-44-29-19-14-23(20-26(29)31(41)42)22-12-10-21(11-13-22)6-5-9-30-38-40(25-17-15-24(16-18-25)33(35,36)37)32(43)39(30)28-8-4-3-7-27(28)34/h3-4,7-8,10-20H,2,5-6,9H2,1H3,(H,41,42)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	56	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARalpha assessed as inhibition of GW7647-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50013739 (CHEMBL3264929) Show SMILES CCn1c(CCCc2ccc(CC(C)(C)C(=O)NS(=O)(=O)c3ccccc3)cc2)nn(Cc2ccc(cc2)C(C)(C)C)c1=O Show InChI InChI=1S/C35H44N4O4S/c1-7-38-31(36-39(33(38)41)25-28-20-22-29(23-21-28)34(2,3)4)15-11-12-26-16-18-27(19-17-26)24-35(5,6)32(40)37-44(42,43)30-13-9-8-10-14-30/h8-10,13-14,16-23H,7,11-12,15,24-25H2,1-6H3,(H,37,40)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at human PPAR-alpha assessed as inhibition of GW7647-induced effect after overnight incubation by cell-based luciferase reporter ...				Bioorg Med Chem Lett 24: 2267-72 (2014) Article DOI: 10.1016/j.bmcl.2014.03.090 BindingDB Entry DOI: 10.7270/Q2GX4D33
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50508141 (CHEMBL4447577) Show SMILES CCOc1ccc(cc1CC(O)=O)-c1ccc(CCCc2nn(-c3ccc(cc3)C(F)(F)F)c(=O)n2-c2cccnc2)cc1 Show InChI InChI=1S/C33H29F3N4O4/c1-2-44-29-17-12-24(19-25(29)20-31(41)42)23-10-8-22(9-11-23)5-3-7-30-38-40(27-15-13-26(14-16-27)33(34,35)36)32(43)39(30)28-6-4-18-37-21-28/h4,6,8-19,21H,2-3,5,7,20H2,1H3,(H,41,42)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	61	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARdelta assessed as inhibition of GW0742-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50508146 (CHEMBL4587456) Show SMILES CCOc1ccc(cc1CC(O)=O)-c1ccc(CCCc2nn(-c3ccc(cc3)C(F)(F)F)c(=O)n2C2CCCCC2)cc1 Show InChI InChI=1S/C34H36F3N3O4/c1-2-44-30-20-15-25(21-26(30)22-32(41)42)24-13-11-23(12-14-24)7-6-10-31-38-40(29-18-16-27(17-19-29)34(35,36)37)33(43)39(31)28-8-4-3-5-9-28/h11-21,28H,2-10,22H2,1H3,(H,41,42)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	66	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARdelta assessed as inhibition of GW0742-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50508146 (CHEMBL4587456) Show SMILES CCOc1ccc(cc1CC(O)=O)-c1ccc(CCCc2nn(-c3ccc(cc3)C(F)(F)F)c(=O)n2C2CCCCC2)cc1 Show InChI InChI=1S/C34H36F3N3O4/c1-2-44-30-20-15-25(21-26(30)22-32(41)42)24-13-11-23(12-14-24)7-6-10-31-38-40(29-18-16-27(17-19-29)34(35,36)37)33(43)39(31)28-8-4-3-5-9-28/h11-21,28H,2-10,22H2,1H3,(H,41,42)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	66	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARalpha assessed as inhibition of GW7647-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50013726 (CHEMBL3264932) Show SMILES CCn1c(CCCc2ccc(cc2)-c2ccc(NS(=O)(=O)c3ccccc3)cn2)nn(Cc2ccc(cc2)C(C)(C)C)c1=O Show InChI InChI=1S/C35H39N5O3S/c1-5-39-33(37-40(34(39)41)25-27-16-20-29(21-17-27)35(2,3)4)13-9-10-26-14-18-28(19-15-26)32-23-22-30(24-36-32)38-44(42,43)31-11-7-6-8-12-31/h6-8,11-12,14-24,38H,5,9-10,13,25H2,1-4H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	77	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at human PPAR-alpha assessed as inhibition of GW7647-induced effect after overnight incubation by cell-based luciferase reporter ...				Bioorg Med Chem Lett 24: 2267-72 (2014) Article DOI: 10.1016/j.bmcl.2014.03.090 BindingDB Entry DOI: 10.7270/Q2GX4D33
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50013737 (CHEMBL3264927) Show SMILES CCn1c(CCCc2ccc(OC(C)(C)C(=O)NS(=O)(=O)c3ccoc3)cc2)nn(Cc2ccc(cc2)C(C)(C)C)c1=O Show InChI InChI=1S/C32H40N4O6S/c1-7-35-28(33-36(30(35)38)21-24-11-15-25(16-12-24)31(2,3)4)10-8-9-23-13-17-26(18-14-23)42-32(5,6)29(37)34-43(39,40)27-19-20-41-22-27/h11-20,22H,7-10,21H2,1-6H3,(H,34,37)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	78	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at human PPAR-alpha assessed as inhibition of GW7647-induced effect after overnight incubation by cell-based luciferase reporter ...				Bioorg Med Chem Lett 24: 2267-72 (2014) Article DOI: 10.1016/j.bmcl.2014.03.090 BindingDB Entry DOI: 10.7270/Q2GX4D33
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50508150 (CHEMBL4547480) Show SMILES CCOc1ccc(cc1CC(O)=O)-c1ccc(CCCc2nn(-c3ccc(SC)cc3)c(=O)n2-c2ccccc2F)cc1 |(24.92,-17.53,;23.59,-18.32,;22.25,-17.56,;20.92,-18.35,;19.57,-17.59,;18.25,-18.38,;18.27,-19.9,;19.61,-20.67,;20.94,-19.89,;22.28,-20.65,;22.29,-22.19,;20.97,-22.97,;23.63,-22.94,;16.95,-20.69,;16.96,-22.23,;15.63,-23.01,;14.29,-22.25,;12.97,-23.03,;11.63,-22.27,;10.3,-23.05,;8.96,-22.29,;8.48,-20.83,;6.94,-20.83,;6.16,-19.5,;6.92,-18.17,;6.14,-16.84,;4.6,-16.85,;3.82,-15.53,;4.57,-14.19,;3.84,-18.2,;4.63,-19.52,;6.47,-22.3,;5.01,-22.78,;7.72,-23.19,;7.73,-24.73,;9.06,-25.5,;9.07,-27.05,;7.73,-27.82,;6.4,-27.05,;6.4,-25.5,;5.06,-24.73,;14.28,-20.71,;15.6,-19.93,)| Show InChI InChI=1S/C34H32FN3O4S/c1-3-42-31-20-15-25(21-26(31)22-33(39)40)24-13-11-23(12-14-24)7-6-10-32-36-38(27-16-18-28(43-2)19-17-27)34(41)37(32)30-9-5-4-8-29(30)35/h4-5,8-9,11-21H,3,6-7,10,22H2,1-2H3,(H,39,40)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	79	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARdelta assessed as inhibition of GW0742-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50013733 (CHEMBL3264923) Show SMILES CCn1c(CCCc2ccc(OC(C)(C)C(=O)NS(=O)(=O)c3cccnc3)cc2)nn(Cc2ccc(cc2)C(C)(C)C)c1=O Show InChI InChI=1S/C33H41N5O5S/c1-7-37-29(35-38(31(37)40)23-25-13-17-26(18-14-25)32(2,3)4)12-8-10-24-15-19-27(20-16-24)43-33(5,6)30(39)36-44(41,42)28-11-9-21-34-22-28/h9,11,13-22H,7-8,10,12,23H2,1-6H3,(H,36,39)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	80	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at human PPAR-alpha assessed as inhibition of GW7647-induced effect after overnight incubation by cell-based luciferase reporter ...				Bioorg Med Chem Lett 24: 2267-72 (2014) Article DOI: 10.1016/j.bmcl.2014.03.090 BindingDB Entry DOI: 10.7270/Q2GX4D33
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50508143 (CHEMBL4443720) Show SMILES CCOc1ccc(cc1CC(O)=O)-c1ccc(CCCc2nn(-c3ccc(cc3)C(F)(F)F)c(=O)n2-c2ccccc2C)cc1 |(74.83,-5.42,;73.5,-6.2,;72.16,-5.45,;70.83,-6.23,;69.48,-5.47,;68.16,-6.26,;68.19,-7.79,;69.52,-8.55,;70.85,-7.77,;72.19,-8.53,;72.2,-10.07,;70.88,-10.85,;73.54,-10.83,;66.86,-8.57,;66.87,-10.11,;65.54,-10.89,;64.21,-10.13,;62.88,-10.91,;61.54,-10.15,;60.21,-10.93,;58.87,-10.17,;58.39,-8.71,;56.85,-8.71,;56.07,-7.39,;56.83,-6.05,;56.05,-4.72,;54.51,-4.74,;53.75,-6.09,;54.54,-7.41,;53.73,-3.41,;54.49,-2.07,;52.19,-3.43,;52.94,-2.07,;56.38,-10.18,;54.92,-10.66,;57.63,-11.08,;57.64,-12.62,;56.31,-13.38,;56.31,-14.91,;57.64,-15.69,;58.98,-14.91,;58.98,-13.37,;60.31,-12.59,;64.19,-8.59,;65.51,-7.81,)| Show InChI InChI=1S/C35H32F3N3O4/c1-3-45-31-20-15-26(21-27(31)22-33(42)43)25-13-11-24(12-14-25)8-6-10-32-39-41(29-18-16-28(17-19-29)35(36,37)38)34(44)40(32)30-9-5-4-7-23(30)2/h4-5,7,9,11-21H,3,6,8,10,22H2,1-2H3,(H,42,43)	PDB UniProtKB/SwissProt 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
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARalpha assessed as inhibition of GW7647-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50508158 (CHEMBL4474275) Show SMILES CCOc1ccc(cc1CC(O)=O)-c1ccc(CCCc2nn(-c3ccc(cc3)C(F)(F)F)c(=O)n2-c2ccccc2OC)cc1 |(24.22,-19.3,;22.89,-20.08,;21.55,-19.33,;20.22,-20.11,;18.87,-19.36,;17.55,-20.14,;17.57,-21.67,;18.91,-22.44,;20.24,-21.65,;21.58,-22.41,;21.59,-23.95,;20.27,-24.73,;22.93,-24.71,;16.25,-22.45,;16.26,-23.99,;14.93,-24.77,;13.59,-24.01,;12.27,-24.79,;10.93,-24.03,;9.6,-24.81,;8.26,-24.06,;7.78,-22.59,;6.24,-22.6,;5.46,-21.27,;6.22,-19.93,;5.44,-18.61,;3.9,-18.62,;3.14,-19.97,;3.93,-21.29,;3.12,-17.29,;3.87,-15.95,;1.58,-17.31,;2.33,-15.95,;5.77,-24.06,;4.31,-24.55,;7.02,-24.96,;7.03,-26.5,;5.7,-27.26,;5.7,-28.8,;7.03,-29.57,;8.37,-28.8,;8.37,-27.25,;9.7,-26.48,;11.04,-27.24,;13.58,-22.48,;14.9,-21.69,)| Show InChI InChI=1S/C35H32F3N3O5/c1-3-46-30-20-15-25(21-26(30)22-33(42)43)24-13-11-23(12-14-24)7-6-10-32-39-41(28-18-16-27(17-19-28)35(36,37)38)34(44)40(32)29-8-4-5-9-31(29)45-2/h4-5,8-9,11-21H,3,6-7,10,22H2,1-2H3,(H,42,43)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	83	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARdelta assessed as inhibition of GW0742-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50508127 (CHEMBL4449687) Show SMILES CCOc1ccc(cc1CC(O)=O)-c1ccc(CCCc2nn(-c3ccc(cc3)C(F)(F)F)c(=O)n2-c2ccccc2F)cc1 |(50.85,-41.06,;49.52,-41.85,;48.18,-41.09,;46.86,-41.88,;45.51,-41.12,;44.19,-41.9,;44.21,-43.43,;45.54,-44.2,;46.87,-43.42,;48.21,-44.18,;48.22,-45.72,;46.9,-46.5,;49.56,-46.47,;42.88,-44.22,;42.89,-45.76,;41.57,-46.54,;40.23,-45.77,;38.9,-46.55,;37.56,-45.8,;36.23,-46.58,;34.89,-45.82,;34.41,-44.35,;32.87,-44.36,;31.96,-43.12,;32.59,-41.71,;31.68,-40.47,;30.15,-40.63,;29.53,-42.05,;30.44,-43.29,;29.24,-39.39,;29.86,-37.98,;27.71,-39.56,;28.14,-38.29,;32.4,-45.83,;30.94,-46.31,;33.65,-46.72,;33.66,-48.26,;34.99,-49.03,;35,-50.58,;33.66,-51.35,;32.33,-50.58,;32.33,-49.03,;31,-48.26,;40.21,-44.24,;41.53,-43.46,)| Show InChI InChI=1S/C34H29F4N3O4/c1-2-45-30-19-14-24(20-25(30)21-32(42)43)23-12-10-22(11-13-23)6-5-9-31-39-41(27-17-15-26(16-18-27)34(36,37)38)33(44)40(31)29-8-4-3-7-28(29)35/h3-4,7-8,10-20H,2,5-6,9,21H2,1H3,(H,42,43)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	113	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARalpha assessed as inhibition of GW7647-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50013743 (CHEMBL3264934) Show SMILES CCn1c(CCCc2ccc(cc2)-c2ccc(NS(C)(=O)=O)cn2)nn(Cc2ccc(cc2)C(C)(C)C)c1=O Show InChI InChI=1S/C30H37N5O3S/c1-6-34-28(32-35(29(34)36)21-23-12-16-25(17-13-23)30(2,3)4)9-7-8-22-10-14-24(15-11-22)27-19-18-26(20-31-27)33-39(5,37)38/h10-20,33H,6-9,21H2,1-5H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	113	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at human PPAR-alpha assessed as inhibition of GW7647-induced effect after overnight incubation by cell-based luciferase reporter ...				Bioorg Med Chem Lett 24: 2267-72 (2014) Article DOI: 10.1016/j.bmcl.2014.03.090 BindingDB Entry DOI: 10.7270/Q2GX4D33
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50013745 (CHEMBL3264937) Show SMILES CCn1c(CCCc2ccc(cc2)-c2ncc(NS(=O)(=O)c3ccccc3)cn2)nn(Cc2ccc(cc2)C(C)(C)C)c1=O Show InChI InChI=1S/C34H38N6O3S/c1-5-39-31(37-40(33(39)41)24-26-16-20-28(21-17-26)34(2,3)4)13-9-10-25-14-18-27(19-15-25)32-35-22-29(23-36-32)38-44(42,43)30-11-7-6-8-12-30/h6-8,11-12,14-23,38H,5,9-10,13,24H2,1-4H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	114	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at human PPAR-alpha assessed as inhibition of GW7647-induced effect after overnight incubation by cell-based luciferase reporter ...				Bioorg Med Chem Lett 24: 2267-72 (2014) Article DOI: 10.1016/j.bmcl.2014.03.090 BindingDB Entry DOI: 10.7270/Q2GX4D33
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50508157 (CHEMBL4471562) Show SMILES CCOc1ccc(cc1CC(O)=O)-c1ccc(CCCc2nn(-c3ccc(cc3)C(F)(F)F)c(=O)n2-c2ccncc2)cc1 Show InChI InChI=1S/C33H29F3N4O4/c1-2-44-29-15-10-24(20-25(29)21-31(41)42)23-8-6-22(7-9-23)4-3-5-30-38-40(28-13-11-26(12-14-28)33(34,35)36)32(43)39(30)27-16-18-37-19-17-27/h6-20H,2-5,21H2,1H3,(H,41,42)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	122	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARalpha assessed as inhibition of GW7647-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50013742 (CHEMBL3264933) Show SMILES CCn1c(CCCc2ccc(cc2)-c2ccc(NS(=O)(=O)c3ccccc3)nc2)nn(Cc2ccc(cc2)C(C)(C)C)c1=O Show InChI InChI=1S/C35H39N5O3S/c1-5-39-33(37-40(34(39)41)25-27-16-21-30(22-17-27)35(2,3)4)13-9-10-26-14-18-28(19-15-26)29-20-23-32(36-24-29)38-44(42,43)31-11-7-6-8-12-31/h6-8,11-12,14-24H,5,9-10,13,25H2,1-4H3,(H,36,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	122	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at human PPAR-alpha assessed as inhibition of GW7647-induced effect after overnight incubation by cell-based luciferase reporter ...				Bioorg Med Chem Lett 24: 2267-72 (2014) Article DOI: 10.1016/j.bmcl.2014.03.090 BindingDB Entry DOI: 10.7270/Q2GX4D33
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50508128 (CHEMBL4539262) Show SMILES CCOc1ccc(cc1CC(O)=O)-c1ccc(CCCc2nn(-c3ccc(cc3)C(F)(F)F)c(=O)n2C2CCCC2)cc1 Show InChI InChI=1S/C33H34F3N3O4/c1-2-43-29-19-14-24(20-25(29)21-31(40)41)23-12-10-22(11-13-23)6-5-9-30-37-39(32(42)38(30)27-7-3-4-8-27)28-17-15-26(16-18-28)33(34,35)36/h10-20,27H,2-9,21H2,1H3,(H,40,41)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	124	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARdelta assessed as inhibition of GW0742-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50508141 (CHEMBL4447577) Show SMILES CCOc1ccc(cc1CC(O)=O)-c1ccc(CCCc2nn(-c3ccc(cc3)C(F)(F)F)c(=O)n2-c2cccnc2)cc1 Show InChI InChI=1S/C33H29F3N4O4/c1-2-44-29-17-12-24(19-25(29)20-31(41)42)23-10-8-22(9-11-23)5-3-7-30-38-40(27-15-13-26(14-16-27)33(34,35)36)32(43)39(30)28-6-4-18-37-21-28/h4,6,8-19,21H,2-3,5,7,20H2,1H3,(H,41,42)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	126	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARalpha assessed as inhibition of GW7647-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50508132 (CHEMBL4546054) Show SMILES CCOc1ccc(cc1C(O)=O)-c1ccc(CCCc2nn(-c3ccc(cc3)C(F)(F)F)c(=O)n2-c2ccccc2F)cc1 |(50.46,-23.1,;49.13,-23.88,;47.79,-23.12,;46.47,-23.91,;45.12,-23.15,;43.8,-23.94,;43.82,-25.47,;45.16,-26.23,;46.48,-25.45,;47.82,-26.21,;49.15,-25.43,;47.84,-27.75,;42.49,-26.25,;42.5,-27.79,;41.18,-28.57,;39.84,-27.81,;38.51,-28.59,;37.17,-27.83,;35.84,-28.61,;34.5,-27.85,;34.02,-26.39,;32.48,-26.39,;31.7,-25.07,;32.47,-23.73,;31.69,-22.4,;30.14,-22.42,;29.39,-23.77,;30.17,-25.09,;29.36,-21.09,;30.12,-19.75,;27.82,-21.1,;28.58,-19.75,;32.01,-27.86,;30.55,-28.34,;33.27,-28.75,;33.27,-30.29,;31.94,-31.06,;31.94,-32.59,;33.27,-33.37,;34.61,-32.59,;34.61,-31.05,;35.94,-30.27,;39.82,-26.27,;41.14,-25.49,)| Show InChI InChI=1S/C33H27F4N3O4/c1-2-44-29-19-14-23(20-26(29)31(41)42)22-12-10-21(11-13-22)6-5-9-30-38-40(25-17-15-24(16-18-25)33(35,36)37)32(43)39(30)28-8-4-3-7-27(28)34/h3-4,7-8,10-20H,2,5-6,9H2,1H3,(H,41,42)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	131	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARdelta assessed as inhibition of GW0742-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50508144 (CHEMBL4545223) Show SMILES CCOc1ccc(cc1CC(O)=O)-c1ccc(CCCc2nn(-c3ccc(cc3)C(F)(F)F)c(=O)n2-c2ccc(cc2)C(C)(C)C)cc1 Show InChI InChI=1S/C38H38F3N3O4/c1-5-48-33-22-13-27(23-28(33)24-35(45)46)26-11-9-25(10-12-26)7-6-8-34-42-44(32-20-16-30(17-21-32)38(39,40)41)36(47)43(34)31-18-14-29(15-19-31)37(2,3)4/h9-23H,5-8,24H2,1-4H3,(H,45,46)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	138	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARdelta assessed as inhibition of GW0742-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50508153 (CHEMBL4549922) Show SMILES CCOc1ccc(cc1CC(O)=O)-c1ccc(CCCc2nn(-c3ccc(OC(F)(F)F)cc3)c(=O)n2-c2ccccc2F)cc1 |(80.09,-3.25,;78.76,-4.04,;77.42,-3.28,;76.09,-4.07,;74.74,-3.31,;73.42,-4.1,;73.44,-5.62,;74.78,-6.39,;76.11,-5.61,;77.45,-6.37,;77.46,-7.91,;76.14,-8.69,;78.8,-8.66,;72.12,-6.41,;72.13,-7.95,;70.8,-8.73,;69.46,-7.97,;68.14,-8.75,;66.8,-7.99,;65.47,-8.77,;64.13,-8.01,;63.65,-6.55,;62.11,-6.55,;61.33,-5.22,;62.09,-3.89,;61.31,-2.56,;59.77,-2.57,;58.99,-1.25,;57.45,-1.26,;56.66,.08,;56.69,-2.6,;55.9,-1.25,;59.01,-3.92,;59.8,-5.24,;61.64,-8.02,;60.18,-8.5,;62.89,-8.91,;62.9,-10.45,;64.23,-11.22,;64.24,-12.77,;62.9,-13.54,;61.57,-12.77,;61.57,-11.22,;60.23,-10.45,;69.45,-6.43,;70.77,-5.65,)| Show InChI InChI=1S/C34H29F4N3O5/c1-2-45-30-19-14-24(20-25(30)21-32(42)43)23-12-10-22(11-13-23)6-5-9-31-39-41(26-15-17-27(18-16-26)46-34(36,37)38)33(44)40(31)29-8-4-3-7-28(29)35/h3-4,7-8,10-20H,2,5-6,9,21H2,1H3,(H,42,43)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	197	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARdelta assessed as inhibition of GW0742-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50508154 (CHEMBL4582294) Show SMILES CCOc1ccc(cc1CC(O)=O)-c1ccc(CCCc2nn(Cc3ccc(cc3)C(C)(C)C)c(=O)n2-c2ccccc2F)cc1 |(75.79,-18.47,;74.47,-19.26,;73.12,-18.5,;71.8,-19.29,;70.45,-18.53,;69.13,-19.32,;69.15,-20.84,;70.49,-21.61,;71.81,-20.83,;73.15,-21.59,;73.17,-23.13,;71.84,-23.91,;74.51,-23.89,;67.82,-21.63,;67.83,-23.17,;66.51,-23.95,;65.17,-23.19,;63.84,-23.97,;62.5,-23.21,;61.17,-23.99,;59.83,-23.23,;59.35,-21.77,;57.81,-21.77,;56.9,-20.53,;57.68,-19.2,;59.22,-19.22,;60,-17.89,;59.24,-16.55,;57.69,-16.54,;56.92,-17.87,;60.01,-15.22,;61.55,-15.23,;59.25,-13.88,;60.78,-13.88,;57.34,-23.24,;55.88,-23.72,;58.6,-24.13,;58.6,-25.67,;59.94,-26.44,;59.94,-27.99,;58.61,-28.76,;57.27,-27.99,;57.27,-26.44,;55.94,-25.67,;65.15,-21.65,;66.47,-20.87,)| Show InChI InChI=1S/C38H40FN3O4/c1-5-46-34-22-19-29(23-30(34)24-36(43)44)28-17-13-26(14-18-28)9-8-12-35-40-41(25-27-15-20-31(21-16-27)38(2,3)4)37(45)42(35)33-11-7-6-10-32(33)39/h6-7,10-11,13-23H,5,8-9,12,24-25H2,1-4H3,(H,43,44)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARalpha assessed as inhibition of GW7647-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50508145 (CHEMBL4450146) Show SMILES CCOc1ccc(cc1CC(O)=O)-c1ccc(CCCc2nn(-c3ccc(cc3)C(F)(F)F)c(=O)n2-c2c(F)cccc2F)cc1 |(24.36,-4.61,;23.03,-5.4,;21.69,-4.64,;20.36,-5.43,;19.01,-4.67,;17.69,-5.46,;17.71,-6.99,;19.05,-7.75,;20.38,-6.97,;21.72,-7.73,;21.73,-9.27,;20.41,-10.05,;23.07,-10.03,;16.39,-7.77,;16.4,-9.31,;15.07,-10.09,;13.73,-9.33,;12.41,-10.11,;11.07,-9.35,;9.74,-10.13,;8.4,-9.37,;7.92,-7.91,;6.38,-7.91,;5.6,-6.58,;6.36,-5.25,;5.58,-3.92,;4.04,-3.94,;3.28,-5.29,;4.07,-6.61,;3.26,-2.61,;4.01,-1.27,;1.72,-2.62,;2.47,-1.27,;5.91,-9.38,;4.45,-9.86,;7.16,-10.27,;7.17,-11.81,;8.51,-12.57,;9.84,-11.79,;8.51,-14.11,;7.17,-14.88,;5.84,-14.11,;5.84,-12.58,;4.5,-11.81,;13.72,-7.79,;15.04,-7.01,)| Show InChI InChI=1S/C34H28F5N3O4/c1-2-46-29-18-13-23(19-24(29)20-31(43)44)22-11-9-21(10-12-22)5-3-8-30-40-42(26-16-14-25(15-17-26)34(37,38)39)33(45)41(30)32-27(35)6-4-7-28(32)36/h4,6-7,9-19H,2-3,5,8,20H2,1H3,(H,43,44)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	216	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at recombinant human PPARalpha assessed as inhibition of GW7647-induced receptor activation after overnight incubation by cell-ba...				Bioorg Med Chem Lett 29: 503-508 (2019) Article DOI: 10.1016/j.bmcl.2018.12.045 BindingDB Entry DOI: 10.7270/Q2XK8JVQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50013746 (CHEMBL3264938) Show SMILES CCn1c(CCCc2ccc(cc2)-c2cnc(NS(=O)(=O)c3ccccc3)cn2)nn(Cc2ccc(cc2)C(C)(C)C)c1=O Show InChI InChI=1S/C34H38N6O3S/c1-5-39-32(37-40(33(39)41)24-26-16-20-28(21-17-26)34(2,3)4)13-9-10-25-14-18-27(19-15-25)30-22-36-31(23-35-30)38-44(42,43)29-11-7-6-8-12-29/h6-8,11-12,14-23H,5,9-10,13,24H2,1-4H3,(H,36,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	218	n/a	n/a	n/a	n/a	n/a	n/a
Inception Sciences Curated by ChEMBL					Assay Description Antagonist activity at human PPAR-alpha assessed as inhibition of GW7647-induced effect after overnight incubation by cell-based luciferase reporter ...				Bioorg Med Chem Lett 24: 2267-72 (2014) Article DOI: 10.1016/j.bmcl.2014.03.090 BindingDB Entry DOI: 10.7270/Q2GX4D33
					More data for this Ligand-Target Pair

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