Compile Data Set for Download or QSAR

Found 86 hits Enz. Inhib. hit(s) with all data for entry = 50017261   

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))	BDBM50179830 ((S)-2-(4-(3-(2-chloro-4-cyclohexylphenoxy)propoxy)...) Show SMILES CC[C@@](C)(Cc1ccc(OCCCOc2ccc(cc2Cl)C2CCCCC2)cc1)C(O)=O Show InChI InChI=1S/C27H35ClO4/c1-3-27(2,26(29)30)19-20-10-13-23(14-11-20)31-16-7-17-32-25-15-12-22(18-24(25)28)21-8-5-4-6-9-21/h10-15,18,21H,3-9,16-17,19H2,1-2H3,(H,29,30)/t27-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR alpha				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50179833 ((S)-2-(4-(3-(2-chloro-4-(trifluoromethyl)phenoxy)p...) Show SMILES CC[C@@](C)(Cc1ccc(OCCCOc2ccc(cc2Cl)C(F)(F)F)cc1)C(O)=O Show InChI InChI=1S/C22H24ClF3O4/c1-3-21(2,20(27)28)14-15-5-8-17(9-6-15)29-11-4-12-30-19-10-7-16(13-18(19)23)22(24,25)26/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,27,28)/t21-/m0/s1	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
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR alpha				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50179824 ((S)-2-(4-(3-(2-chloro-4-(trifluoromethoxy)phenoxy)...) Show SMILES CC[C@@](C)(Cc1ccc(OCCCOc2ccc(OC(F)(F)F)cc2Cl)cc1)C(O)=O Show InChI InChI=1S/C22H24ClF3O5/c1-3-21(2,20(27)28)14-15-5-7-16(8-6-15)29-11-4-12-30-19-10-9-17(13-18(19)23)31-22(24,25)26/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,27,28)/t21-/m0/s1	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
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR alpha				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50179818 (2-(4-(3-(2-chloro-4-(4-fluorophenoxy)phenoxy)propo...) Show SMILES CCC(C)(Cc1ccc(OCCCOc2ccc(Oc3ccc(F)cc3)cc2Cl)cc1)C(O)=O Show InChI InChI=1S/C27H28ClFO5/c1-3-27(2,26(30)31)18-19-5-9-21(10-6-19)32-15-4-16-33-25-14-13-23(17-24(25)28)34-22-11-7-20(29)8-12-22/h5-14,17H,3-4,15-16,18H2,1-2H3,(H,30,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR alpha				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50179826 ((R)-2-(4-(3-(2-chloro-4-(4-fluorophenoxy)phenoxy)p...) Show SMILES CC[C@](C)(Cc1ccc(OCCCOc2ccc(Oc3ccc(F)cc3)cc2Cl)cc1)C(O)=O Show InChI InChI=1S/C27H28ClFO5/c1-3-27(2,26(30)31)18-19-5-9-21(10-6-19)32-15-4-16-33-25-14-13-23(17-24(25)28)34-22-11-7-20(29)8-12-22/h5-14,17H,3-4,15-16,18H2,1-2H3,(H,30,31)/t27-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR alpha				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50179836 ((S)-2-(4-(3-(2-chloro-4-(2,2,2-trifluoroethoxy)phe...) Show SMILES CC[C@@](C)(Cc1ccc(OCCCOc2ccc(OCC(F)(F)F)cc2Cl)cc1)C(O)=O Show InChI InChI=1S/C23H26ClF3O5/c1-3-22(2,21(28)29)14-16-5-7-17(8-6-16)30-11-4-12-31-20-10-9-18(13-19(20)24)32-15-23(25,26)27/h5-10,13H,3-4,11-12,14-15H2,1-2H3,(H,28,29)/t22-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR alpha				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50179816 ((S)-2-(4-(3-(2-chloro-4-(4,4-dimethylcyclohexyl)ph...) Show SMILES CC[C@@](C)(Cc1ccc(OCCCOc2ccc(cc2Cl)C2CCC(C)(C)CC2)cc1)C(O)=O Show InChI InChI=1S/C29H39ClO4/c1-5-29(4,27(31)32)20-21-7-10-24(11-8-21)33-17-6-18-34-26-12-9-23(19-25(26)30)22-13-15-28(2,3)16-14-22/h7-12,19,22H,5-6,13-18,20H2,1-4H3,(H,31,32)/t29-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR alpha				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50179829 (2-(4-(3-(2-chloro-4-(4-fluorophenoxy)phenoxy)propo...) Show SMILES CCC(CC)(Cc1ccc(OCCCOc2ccc(Oc3ccc(F)cc3)cc2Cl)cc1)C(O)=O Show InChI InChI=1S/C28H30ClFO5/c1-3-28(4-2,27(31)32)19-20-6-10-22(11-7-20)33-16-5-17-34-26-15-14-24(18-25(26)29)35-23-12-8-21(30)9-13-23/h6-15,18H,3-5,16-17,19H2,1-2H3,(H,31,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR alpha				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50179828 ((S)-2-((4-(3-(6-chloro-2-oxo-4-(trifluoromethyl)-2...) Show SMILES CC[C@@](C)(Cc1ccc(OCCCOc2cc3oc(=O)cc(c3cc2Cl)C(F)(F)F)cc1)C(O)=O Show InChI InChI=1S/C25H24ClF3O6/c1-3-24(2,23(31)32)14-15-5-7-16(8-6-15)33-9-4-10-34-21-13-20-17(11-19(21)26)18(25(27,28)29)12-22(30)35-20/h5-8,11-13H,3-4,9-10,14H2,1-2H3,(H,31,32)/t24-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR alpha				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50179844 ((S)-2-(4-(3-(2-chloro-4-(methylsulfonyloxy)phenoxy...) Show SMILES CC[C@@](C)(Cc1ccc(OCCCOc2ccc(OS(C)(=O)=O)cc2Cl)cc1)C(O)=O Show InChI InChI=1S/C22H27ClO7S/c1-4-22(2,21(24)25)15-16-6-8-17(9-7-16)28-12-5-13-29-20-11-10-18(14-19(20)23)30-31(3,26)27/h6-11,14H,4-5,12-13,15H2,1-3H3,(H,24,25)/t22-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR alpha				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50179835 (2-(4-(3-(2-chloro-4-(4-fluorophenoxy)phenoxy)propo...) Show SMILES CC(C)(Oc1ccc(OCCCOc2ccc(Oc3ccc(F)cc3)cc2Cl)cc1)C(O)=O Show InChI InChI=1S/C25H24ClFO6/c1-25(2,24(28)29)33-20-10-8-18(9-11-20)30-14-3-15-31-23-13-12-21(16-22(23)26)32-19-6-4-17(27)5-7-19/h4-13,16H,3,14-15H2,1-2H3,(H,28,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR alpha				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50179821 ((S)-2-(4-(3-(2-chlorophenoxy)propoxy)benzyl)-2-met...) Show SMILES CC[C@@](C)(Cc1ccc(OCCCOc2ccccc2Cl)cc1)C(O)=O Show InChI InChI=1S/C21H25ClO4/c1-3-21(2,20(23)24)15-16-9-11-17(12-10-16)25-13-6-14-26-19-8-5-4-7-18(19)22/h4-5,7-12H,3,6,13-15H2,1-2H3,(H,23,24)/t21-/m0/s1	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
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR alpha				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50179823 ((S)-2-methyl-2-((4-(3-(8-methyl-2-oxo-4-(trifluoro...) Show SMILES CC[C@@](C)(Cc1ccc(OCCCOc2ccc3c(cc(=O)oc3c2C)C(F)(F)F)cc1)C(O)=O Show InChI InChI=1S/C26H27F3O6/c1-4-25(3,24(31)32)15-17-6-8-18(9-7-17)33-12-5-13-34-21-11-10-19-20(26(27,28)29)14-22(30)35-23(19)16(21)2/h6-11,14H,4-5,12-13,15H2,1-3H3,(H,31,32)/t25-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	49	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR alpha				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50179837 (3-(4-(3-(2-chloro-4-(4-fluorophenoxy)phenoxy)propo...) Show SMILES OC(=O)CCc1ccc(OCCCOc2ccc(Oc3ccc(F)cc3)cc2Cl)cc1 Show InChI InChI=1S/C24H22ClFO5/c25-22-16-21(31-20-9-5-18(26)6-10-20)11-12-23(22)30-15-1-14-29-19-7-2-17(3-8-19)4-13-24(27)28/h2-3,5-12,16H,1,4,13-15H2,(H,27,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>50	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR delta				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50179838 ((S)-2-(4-(3-(2-chloro-4-(4-fluorophenoxy)phenoxy)p...) Show SMILES CC[C@@](C)(Cc1ccc(OCCCOc2ccc(Oc3ccc(F)cc3)cc2Cl)cc1)C(O)=O Show InChI InChI=1S/C27H28ClFO5/c1-3-27(2,26(30)31)18-19-5-9-21(10-6-19)32-15-4-16-33-25-14-13-23(17-24(25)28)34-22-11-7-20(29)8-12-22/h5-14,17H,3-4,15-16,18H2,1-2H3,(H,30,31)/t27-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	101	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR alpha				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50179822 (3-(4-(3-(2-chloro-4-(4-fluorophenoxy)phenoxy)propo...) Show SMILES OC(=O)C(Cc1ccc(OCCCOc2ccc(Oc3ccc(F)cc3)cc2Cl)cc1)C1CCC1 Show InChI InChI=1S/C28H28ClFO5/c29-26-18-24(35-23-11-7-21(30)8-12-23)13-14-27(26)34-16-2-15-33-22-9-5-19(6-10-22)17-25(28(31)32)20-3-1-4-20/h5-14,18,20,25H,1-4,15-17H2,(H,31,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	116	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR alpha				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50179842 ((S)-2-((4-(3-(6-chloro-2,2-diethyl-4-(trifluoromet...) Show SMILES CC[C@@](C)(Cc1ccc(OCCCOc2cc3OC(CC)(CC)C=C(c3cc2Cl)C(F)(F)F)cc1)C(O)=O |c:23| Show InChI InChI=1S/C29H34ClF3O5/c1-5-27(4,26(34)35)17-19-9-11-20(12-10-19)36-13-8-14-37-25-16-24-21(15-23(25)30)22(29(31,32)33)18-28(6-2,7-3)38-24/h9-12,15-16,18H,5-8,13-14,17H2,1-4H3,(H,34,35)/t27-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	125	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR alpha				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50179843 (2-(4-(3-(2-chloro-4-(4-fluorophenoxy)phenoxy)propo...) Show SMILES CCCC(Cc1ccc(OCCCOc2ccc(Oc3ccc(F)cc3)cc2Cl)cc1)C(O)=O Show InChI InChI=1S/C27H28ClFO5/c1-2-4-20(27(30)31)17-19-5-9-22(10-6-19)32-15-3-16-33-26-14-13-24(18-25(26)28)34-23-11-7-21(29)8-12-23/h5-14,18,20H,2-4,15-17H2,1H3,(H,30,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	130	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR alpha				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50179823 ((S)-2-methyl-2-((4-(3-(8-methyl-2-oxo-4-(trifluoro...) Show SMILES CC[C@@](C)(Cc1ccc(OCCCOc2ccc3c(cc(=O)oc3c2C)C(F)(F)F)cc1)C(O)=O Show InChI InChI=1S/C26H27F3O6/c1-4-25(3,24(31)32)15-17-6-8-18(9-7-17)33-12-5-13-34-21-11-10-19-20(26(27,28)29)14-22(30)35-23(19)16(21)2/h6-11,14H,4-5,12-13,15H2,1-3H3,(H,31,32)/t25-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	134	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR delta				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50179820 (2-(4-(3-(2-chloro-4-(4-fluorophenoxy)phenoxy)propo...) Show SMILES CCC(Cc1ccc(OCCCOc2ccc(Oc3ccc(F)cc3)cc2Cl)cc1)C(O)=O Show InChI InChI=1S/C26H26ClFO5/c1-2-19(26(29)30)16-18-4-8-21(9-5-18)31-14-3-15-32-25-13-12-23(17-24(25)27)33-22-10-6-20(28)7-11-22/h4-13,17,19H,2-3,14-16H2,1H3,(H,29,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	156	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR alpha				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50179817 ((S)-2-((4-(3-(8-chloro-2-oxo-4-(trifluoromethyl)-2...) Show SMILES CC[C@@](C)(Cc1ccc(OCCCOc2ccc3c(cc(=O)oc3c2Cl)C(F)(F)F)cc1)C(O)=O Show InChI InChI=1S/C25H24ClF3O6/c1-3-24(2,23(31)32)14-15-5-7-16(8-6-15)33-11-4-12-34-19-10-9-17-18(25(27,28)29)13-20(30)35-22(17)21(19)26/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,31,32)/t24-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	157	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR alpha				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50179841 (3-(4-(3-(2-chloro-4-(4-fluorophenoxy)phenoxy)propo...) Show SMILES CC(Cc1ccc(OCCCOc2ccc(Oc3ccc(F)cc3)cc2Cl)cc1)C(O)=O Show InChI InChI=1S/C25H24ClFO5/c1-17(25(28)29)15-18-3-7-20(8-4-18)30-13-2-14-31-24-12-11-22(16-23(24)26)32-21-9-5-19(27)6-10-21/h3-12,16-17H,2,13-15H2,1H3,(H,28,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	208	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR alpha				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50179839 (3-(4-(3-(2-chloro-4-(4-fluorophenoxy)phenoxy)propo...) Show SMILES OC(=O)C(Cc1ccc(OCCCOc2ccc(Oc3ccc(F)cc3)cc2Cl)cc1)c1ccccc1 Show InChI InChI=1S/C30H26ClFO5/c31-28-20-26(37-25-13-9-23(32)10-14-25)15-16-29(28)36-18-4-17-35-24-11-7-21(8-12-24)19-27(30(33)34)22-5-2-1-3-6-22/h1-3,5-16,20,27H,4,17-19H2,(H,33,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	262	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR alpha				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50179846 ((S)-2-methyl-2-((4-(3-(2-oxo-4-(trifluoromethyl)-2...) Show SMILES CC[C@@](C)(Cc1ccc(OCCCOc2ccc3c(cc(=O)oc3c2)C(F)(F)F)cc1)C(O)=O Show InChI InChI=1S/C25H25F3O6/c1-3-24(2,23(30)31)15-16-5-7-17(8-6-16)32-11-4-12-33-18-9-10-19-20(25(26,27)28)14-22(29)34-21(19)13-18/h5-10,13-14H,3-4,11-12,15H2,1-2H3,(H,30,31)/t24-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	537	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR alpha				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50179833 ((S)-2-(4-(3-(2-chloro-4-(trifluoromethyl)phenoxy)p...) Show SMILES CC[C@@](C)(Cc1ccc(OCCCOc2ccc(cc2Cl)C(F)(F)F)cc1)C(O)=O Show InChI InChI=1S/C22H24ClF3O4/c1-3-21(2,20(27)28)14-15-5-8-17(9-6-15)29-11-4-12-30-19-10-7-16(13-18(19)23)22(24,25)26/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,27,28)/t21-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	603	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR delta				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50179837 (3-(4-(3-(2-chloro-4-(4-fluorophenoxy)phenoxy)propo...) Show SMILES OC(=O)CCc1ccc(OCCCOc2ccc(Oc3ccc(F)cc3)cc2Cl)cc1 Show InChI InChI=1S/C24H22ClFO5/c25-22-16-21(31-20-9-5-18(26)6-10-20)11-12-23(22)30-15-1-14-29-19-7-2-17(3-8-19)4-13-24(27)28/h2-3,5-12,16H,1,4,13-15H2,(H,27,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	675	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR alpha				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50179824 ((S)-2-(4-(3-(2-chloro-4-(trifluoromethoxy)phenoxy)...) Show SMILES CC[C@@](C)(Cc1ccc(OCCCOc2ccc(OC(F)(F)F)cc2Cl)cc1)C(O)=O Show InChI InChI=1S/C22H24ClF3O5/c1-3-21(2,20(27)28)14-15-5-7-16(8-6-15)29-11-4-12-30-19-10-9-17(13-18(19)23)31-22(24,25)26/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,27,28)/t21-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	742	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR delta				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50179821 ((S)-2-(4-(3-(2-chlorophenoxy)propoxy)benzyl)-2-met...) Show SMILES CC[C@@](C)(Cc1ccc(OCCCOc2ccccc2Cl)cc1)C(O)=O Show InChI InChI=1S/C21H25ClO4/c1-3-21(2,20(23)24)15-16-9-11-17(12-10-16)25-13-6-14-26-19-8-5-4-7-18(19)22/h4-5,7-12H,3,6,13-15H2,1-2H3,(H,23,24)/t21-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	851	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR gamma				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50179835 (2-(4-(3-(2-chloro-4-(4-fluorophenoxy)phenoxy)propo...) Show SMILES CC(C)(Oc1ccc(OCCCOc2ccc(Oc3ccc(F)cc3)cc2Cl)cc1)C(O)=O Show InChI InChI=1S/C25H24ClFO6/c1-25(2,24(28)29)33-20-10-8-18(9-11-20)30-14-3-15-31-23-13-12-21(16-22(23)26)32-19-6-4-17(27)5-7-19/h4-13,16H,3,14-15H2,1-2H3,(H,28,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	981	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR gamma				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50179826 ((R)-2-(4-(3-(2-chloro-4-(4-fluorophenoxy)phenoxy)p...) Show SMILES CC[C@](C)(Cc1ccc(OCCCOc2ccc(Oc3ccc(F)cc3)cc2Cl)cc1)C(O)=O Show InChI InChI=1S/C27H28ClFO5/c1-3-27(2,26(30)31)18-19-5-9-21(10-6-19)32-15-4-16-33-25-14-13-23(17-24(25)28)34-22-11-7-20(29)8-12-22/h5-14,17H,3-4,15-16,18H2,1-2H3,(H,30,31)/t27-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.09E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR delta				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50179843 (2-(4-(3-(2-chloro-4-(4-fluorophenoxy)phenoxy)propo...) Show SMILES CCCC(Cc1ccc(OCCCOc2ccc(Oc3ccc(F)cc3)cc2Cl)cc1)C(O)=O Show InChI InChI=1S/C27H28ClFO5/c1-2-4-20(27(30)31)17-19-5-9-22(10-6-19)32-15-3-16-33-26-14-13-24(18-25(26)28)34-23-11-7-21(29)8-12-23/h5-14,18,20H,2-4,15-17H2,1H3,(H,30,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.13E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR delta				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50179820 (2-(4-(3-(2-chloro-4-(4-fluorophenoxy)phenoxy)propo...) Show SMILES CCC(Cc1ccc(OCCCOc2ccc(Oc3ccc(F)cc3)cc2Cl)cc1)C(O)=O Show InChI InChI=1S/C26H26ClFO5/c1-2-19(26(29)30)16-18-4-8-21(9-5-18)31-14-3-15-32-25-13-12-23(17-24(25)27)33-22-10-6-20(28)7-11-22/h4-13,17,19H,2-3,14-16H2,1H3,(H,29,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.17E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR delta				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50179818 (2-(4-(3-(2-chloro-4-(4-fluorophenoxy)phenoxy)propo...) Show SMILES CCC(C)(Cc1ccc(OCCCOc2ccc(Oc3ccc(F)cc3)cc2Cl)cc1)C(O)=O Show InChI InChI=1S/C27H28ClFO5/c1-3-27(2,26(30)31)18-19-5-9-21(10-6-19)32-15-4-16-33-25-14-13-23(17-24(25)28)34-22-11-7-20(29)8-12-22/h5-14,17H,3-4,15-16,18H2,1-2H3,(H,30,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.24E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR gamma				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50179839 (3-(4-(3-(2-chloro-4-(4-fluorophenoxy)phenoxy)propo...) Show SMILES OC(=O)C(Cc1ccc(OCCCOc2ccc(Oc3ccc(F)cc3)cc2Cl)cc1)c1ccccc1 Show InChI InChI=1S/C30H26ClFO5/c31-28-20-26(37-25-13-9-23(32)10-14-25)15-16-29(28)36-18-4-17-35-24-11-7-21(8-12-24)19-27(30(33)34)22-5-2-1-3-6-22/h1-3,5-16,20,27H,4,17-19H2,(H,33,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.34E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR delta				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50179822 (3-(4-(3-(2-chloro-4-(4-fluorophenoxy)phenoxy)propo...) Show SMILES OC(=O)C(Cc1ccc(OCCCOc2ccc(Oc3ccc(F)cc3)cc2Cl)cc1)C1CCC1 Show InChI InChI=1S/C28H28ClFO5/c29-26-18-24(35-23-11-7-21(30)8-12-23)13-14-27(26)34-16-2-15-33-22-9-5-19(6-10-22)17-25(28(31)32)20-3-1-4-20/h5-14,18,20,25H,1-4,15-17H2,(H,31,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.35E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR delta				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50179830 ((S)-2-(4-(3-(2-chloro-4-cyclohexylphenoxy)propoxy)...) Show SMILES CC[C@@](C)(Cc1ccc(OCCCOc2ccc(cc2Cl)C2CCCCC2)cc1)C(O)=O Show InChI InChI=1S/C27H35ClO4/c1-3-27(2,26(29)30)19-20-10-13-23(14-11-20)31-16-7-17-32-25-15-12-22(18-24(25)28)21-8-5-4-6-9-21/h10-15,18,21H,3-9,16-17,19H2,1-2H3,(H,29,30)/t27-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.85E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR gamma				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50179835 (2-(4-(3-(2-chloro-4-(4-fluorophenoxy)phenoxy)propo...) Show SMILES CC(C)(Oc1ccc(OCCCOc2ccc(Oc3ccc(F)cc3)cc2Cl)cc1)C(O)=O Show InChI InChI=1S/C25H24ClFO6/c1-25(2,24(28)29)33-20-10-8-18(9-11-20)30-14-3-15-31-23-13-12-21(16-22(23)26)32-19-6-4-17(27)5-7-19/h4-13,16H,3,14-15H2,1-2H3,(H,28,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.39E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR delta				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50179838 ((S)-2-(4-(3-(2-chloro-4-(4-fluorophenoxy)phenoxy)p...) Show SMILES CC[C@@](C)(Cc1ccc(OCCCOc2ccc(Oc3ccc(F)cc3)cc2Cl)cc1)C(O)=O Show InChI InChI=1S/C27H28ClFO5/c1-3-27(2,26(30)31)18-19-5-9-21(10-6-19)32-15-4-16-33-25-14-13-23(17-24(25)28)34-22-11-7-20(29)8-12-22/h5-14,17H,3-4,15-16,18H2,1-2H3,(H,30,31)/t27-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.41E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR delta				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50179817 ((S)-2-((4-(3-(8-chloro-2-oxo-4-(trifluoromethyl)-2...) Show SMILES CC[C@@](C)(Cc1ccc(OCCCOc2ccc3c(cc(=O)oc3c2Cl)C(F)(F)F)cc1)C(O)=O Show InChI InChI=1S/C25H24ClF3O6/c1-3-24(2,23(31)32)14-15-5-7-16(8-6-15)33-11-4-12-34-19-10-9-17-18(25(27,28)29)13-20(30)35-22(17)21(19)26/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,31,32)/t24-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.27E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR delta				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50179816 ((S)-2-(4-(3-(2-chloro-4-(4,4-dimethylcyclohexyl)ph...) Show SMILES CC[C@@](C)(Cc1ccc(OCCCOc2ccc(cc2Cl)C2CCC(C)(C)CC2)cc1)C(O)=O Show InChI InChI=1S/C29H39ClO4/c1-5-29(4,27(31)32)20-21-7-10-24(11-8-21)33-17-6-18-34-26-12-9-23(19-25(26)30)22-13-15-28(2,3)16-14-22/h7-12,19,22H,5-6,13-18,20H2,1-4H3,(H,31,32)/t29-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.61E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR gamma				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50179841 (3-(4-(3-(2-chloro-4-(4-fluorophenoxy)phenoxy)propo...) Show SMILES CC(Cc1ccc(OCCCOc2ccc(Oc3ccc(F)cc3)cc2Cl)cc1)C(O)=O Show InChI InChI=1S/C25H24ClFO5/c1-17(25(28)29)15-18-3-7-20(8-4-18)30-13-2-14-31-24-12-11-22(16-23(24)26)32-21-9-5-19(27)6-10-21/h3-12,16-17H,2,13-15H2,1H3,(H,28,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.07E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR delta				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50179821 ((S)-2-(4-(3-(2-chlorophenoxy)propoxy)benzyl)-2-met...) Show SMILES CC[C@@](C)(Cc1ccc(OCCCOc2ccccc2Cl)cc1)C(O)=O Show InChI InChI=1S/C21H25ClO4/c1-3-21(2,20(23)24)15-16-9-11-17(12-10-16)25-13-6-14-26-19-8-5-4-7-18(19)22/h4-5,7-12H,3,6,13-15H2,1-2H3,(H,23,24)/t21-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.63E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR delta				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50179840 ((S)-2-(4-(3-(2-chloro-4-(2,2,2-trifluoroethyl)phen...) Show SMILES CC[C@@](C)(Cc1ccc(OCCCOc2ccc(CC(F)(F)F)cc2Cl)cc1)C(O)=O Show InChI InChI=1S/C23H26ClF3O4/c1-3-22(2,21(28)29)14-16-5-8-18(9-6-16)30-11-4-12-31-20-10-7-17(13-19(20)24)15-23(25,26)27/h5-10,13H,3-4,11-12,14-15H2,1-2H3,(H,28,29)/t22-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>6.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR gamma				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50179815 ((S)-2-methyl-2-((4-(3-(4-methyl-2-oxo-1,2-dihydroq...) Show SMILES CC[C@@](C)(Cc1ccc(OCCCOc2ccc3c(C)cc(=O)[nH]c3c2)cc1)C(O)=O Show InChI InChI=1S/C25H29NO5/c1-4-25(3,24(28)29)16-18-6-8-19(9-7-18)30-12-5-13-31-20-10-11-21-17(2)14-23(27)26-22(21)15-20/h6-11,14-15H,4-5,12-13,16H2,1-3H3,(H,26,27)(H,28,29)/t25-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.09E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR alpha				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50179837 (3-(4-(3-(2-chloro-4-(4-fluorophenoxy)phenoxy)propo...) Show SMILES OC(=O)CCc1ccc(OCCCOc2ccc(Oc3ccc(F)cc3)cc2Cl)cc1 Show InChI InChI=1S/C24H22ClFO5/c25-22-16-21(31-20-9-5-18(26)6-10-20)11-12-23(22)30-15-1-14-29-19-7-2-17(3-8-19)4-13-24(27)28/h2-3,5-12,16H,1,4,13-15H2,(H,27,28)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.44E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR gamma				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50179840 ((S)-2-(4-(3-(2-chloro-4-(2,2,2-trifluoroethyl)phen...) Show SMILES CC[C@@](C)(Cc1ccc(OCCCOc2ccc(CC(F)(F)F)cc2Cl)cc1)C(O)=O Show InChI InChI=1S/C23H26ClF3O4/c1-3-22(2,21(28)29)14-16-5-8-18(9-6-16)30-11-4-12-31-20-10-7-17(13-19(20)24)15-23(25,26)27/h5-10,13H,3-4,11-12,14-15H2,1-2H3,(H,28,29)/t22-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>7.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR delta				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50179816 ((S)-2-(4-(3-(2-chloro-4-(4,4-dimethylcyclohexyl)ph...) Show SMILES CC[C@@](C)(Cc1ccc(OCCCOc2ccc(cc2Cl)C2CCC(C)(C)CC2)cc1)C(O)=O Show InChI InChI=1S/C29H39ClO4/c1-5-29(4,27(31)32)20-21-7-10-24(11-8-21)33-17-6-18-34-26-12-9-23(19-25(26)30)22-13-15-28(2,3)16-14-22/h7-12,19,22H,5-6,13-18,20H2,1-4H3,(H,31,32)/t29-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>3.00E+3	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Transactivation by human PPAR gamma in COS1 cells				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50179819 (2-(4-(4-(2-chloro-4-(4-fluorophenoxy)phenoxy)butox...) Show SMILES CC(C)(Oc1ccc(OCCCCOc2ccc(Oc3ccc(F)cc3)cc2Cl)cc1)C(O)=O Show InChI InChI=1S/C26H26ClFO6/c1-26(2,25(29)30)34-21-11-9-19(10-12-21)31-15-3-4-16-32-24-14-13-22(17-23(24)27)33-20-7-5-18(28)6-8-20/h5-14,17H,3-4,15-16H2,1-2H3,(H,29,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	7.69E+3	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR gamma				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50179822 (3-(4-(3-(2-chloro-4-(4-fluorophenoxy)phenoxy)propo...) Show SMILES OC(=O)C(Cc1ccc(OCCCOc2ccc(Oc3ccc(F)cc3)cc2Cl)cc1)C1CCC1 Show InChI InChI=1S/C28H28ClFO5/c29-26-18-24(35-23-11-7-21(30)8-12-23)13-14-27(26)34-16-2-15-33-22-9-5-19(6-10-22)17-25(28(31)32)20-3-1-4-20/h5-14,18,20,25H,1-4,15-17H2,(H,31,32)	PDB UniProtKB/SwissProt antibodypedia 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
Merck Research Laboratories Curated by ChEMBL					Assay Description Transactivation by human PPAR alpha in COS1 cells				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50179819 (2-(4-(4-(2-chloro-4-(4-fluorophenoxy)phenoxy)butox...) Show SMILES CC(C)(Oc1ccc(OCCCCOc2ccc(Oc3ccc(F)cc3)cc2Cl)cc1)C(O)=O Show InChI InChI=1S/C26H26ClFO6/c1-26(2,25(29)30)34-21-11-9-19(10-12-21)31-15-3-4-16-32-24-14-13-22(17-23(24)27)33-20-7-5-18(28)6-8-20/h5-14,17H,3-4,15-16H2,1-2H3,(H,29,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	66	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human PPAR alpha				Bioorg Med Chem Lett 16: 1673-8 (2006) Article DOI: 10.1016/j.bmcl.2005.12.022 BindingDB Entry DOI: 10.7270/Q2930SRT
					More data for this Ligand-Target Pair

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