Compile Data Set for Download or QSAR

Found 53 hits with Last Name = 'martín' and Initial = 'ja'   

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
Glutamate racemase (Lactobacillus fermentum)	BDBM50118891 ((4S)-4-(2-NAPHTHYLMETHYL)-D-GLUTAMIC ACID | 2-Amin...) Show SMILES N[C@H](C[C@H](Cc1ccc2ccccc2c1)C(O)=O)C(O)=O Show InChI InChI=1S/C16H17NO4/c17-14(16(20)21)9-13(15(18)19)8-10-5-6-11-3-1-2-4-12(11)7-10/h1-7,13-14H,8-9,17H2,(H,18,19)(H,20,21)/t13-,14+/m0/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem Similars	PubMed	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Eli Lilly and Co. Curated by ChEMBL					Assay Description Binding affinity against Glutamate Racemase				J Med Chem 45: 4559-70 (2002) BindingDB Entry DOI: 10.7270/Q2B857F3
					More data for this Ligand-Target Pair
Metabotropic glutamate receptor 2 (Homo sapiens (Human))	BDBM50056272 ((1S,2S,5R,6S)-2-Amino-bicyclo[3.1.0]hexane-2,6-dic...) Show SMILES N[C@]1(CC[C@H]2[C@@H]([C@@H]12)C(O)=O)C(O)=O |r| Show InChI InChI=1S/C8H11NO4/c9-8(7(12)13)2-1-3-4(5(3)8)6(10)11/h3-5H,1-2,9H2,(H,10,11)(H,12,13)/t3-,4-,5-,8-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	85	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lilly, S.A. Curated by ChEMBL					Assay Description Inhibition of [3H]LY-341,495 binding to recombinant human mGlu2 receptors				J Med Chem 48: 5305-20 (2005) Article DOI: 10.1021/jm050235r BindingDB Entry DOI: 10.7270/Q2WM1F5W
					More data for this Ligand-Target Pair				3D Structure (crystal)
Metabotropic glutamate receptor 3 (Homo sapiens (Human))	BDBM50056272 ((1S,2S,5R,6S)-2-Amino-bicyclo[3.1.0]hexane-2,6-dic...) Show SMILES N[C@]1(CC[C@H]2[C@@H]([C@@H]12)C(O)=O)C(O)=O |r| Show InChI InChI=1S/C8H11NO4/c9-8(7(12)13)2-1-3-4(5(3)8)6(10)11/h3-5H,1-2,9H2,(H,10,11)(H,12,13)/t3-,4-,5-,8-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	126	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lilly, S.A. Curated by ChEMBL					Assay Description Inhibition of [3H]LY-341,495 binding to recombinant human mGlu3 receptors				J Med Chem 48: 5305-20 (2005) Article DOI: 10.1021/jm050235r BindingDB Entry DOI: 10.7270/Q2WM1F5W
					More data for this Ligand-Target Pair				3D Structure (crystal)
Metabotropic glutamate receptor 3 (Homo sapiens (Human))	BDBM50171487 ((1S,2S,5R,6S)-2-((S)-2-Amino-propionylamino)-bicyc...) Show SMILES C[C@H](N)C(=O)N[C@]1(CC[C@H]2[C@@H]([C@@H]12)C(O)=O)C(O)=O Show InChI InChI=1S/C11H16N2O5/c1-4(12)8(14)13-11(10(17)18)3-2-5-6(7(5)11)9(15)16/h4-7H,2-3,12H2,1H3,(H,13,14)(H,15,16)(H,17,18)/t4-,5-,6-,7-,11-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lilly, S.A. Curated by ChEMBL					Assay Description Inhibition of [3H]LY-341,495 binding to recombinant human mGlu3 receptors				J Med Chem 48: 5305-20 (2005) Article DOI: 10.1021/jm050235r BindingDB Entry DOI: 10.7270/Q2WM1F5W
					More data for this Ligand-Target Pair
Metabotropic glutamate receptor 2 (Homo sapiens (Human))	BDBM50171487 ((1S,2S,5R,6S)-2-((S)-2-Amino-propionylamino)-bicyc...) Show SMILES C[C@H](N)C(=O)N[C@]1(CC[C@H]2[C@@H]([C@@H]12)C(O)=O)C(O)=O Show InChI InChI=1S/C11H16N2O5/c1-4(12)8(14)13-11(10(17)18)3-2-5-6(7(5)11)9(15)16/h4-7H,2-3,12H2,1H3,(H,13,14)(H,15,16)(H,17,18)/t4-,5-,6-,7-,11-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lilly, S.A. Curated by ChEMBL					Assay Description Inhibition of [3H]LY-341,495 binding to mGlu2 receptors of rat brain				J Med Chem 48: 5305-20 (2005) Article DOI: 10.1021/jm050235r BindingDB Entry DOI: 10.7270/Q2WM1F5W
					More data for this Ligand-Target Pair
Metabotropic glutamate receptor 2 (Homo sapiens (Human))	BDBM50171487 ((1S,2S,5R,6S)-2-((S)-2-Amino-propionylamino)-bicyc...) Show SMILES C[C@H](N)C(=O)N[C@]1(CC[C@H]2[C@@H]([C@@H]12)C(O)=O)C(O)=O Show InChI InChI=1S/C11H16N2O5/c1-4(12)8(14)13-11(10(17)18)3-2-5-6(7(5)11)9(15)16/h4-7H,2-3,12H2,1H3,(H,13,14)(H,15,16)(H,17,18)/t4-,5-,6-,7-,11-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lilly, S.A. Curated by ChEMBL					Assay Description Inhibition of [3H]LY-341,495 binding to recombinant human mGlu2 receptors				J Med Chem 48: 5305-20 (2005) Article DOI: 10.1021/jm050235r BindingDB Entry DOI: 10.7270/Q2WM1F5W
					More data for this Ligand-Target Pair
Metabotropic glutamate receptor 2 (Homo sapiens (Human))	BDBM50056272 ((1S,2S,5R,6S)-2-Amino-bicyclo[3.1.0]hexane-2,6-dic...) Show SMILES N[C@]1(CC[C@H]2[C@@H]([C@@H]12)C(O)=O)C(O)=O |r| Show InChI InChI=1S/C8H11NO4/c9-8(7(12)13)2-1-3-4(5(3)8)6(10)11/h3-5H,1-2,9H2,(H,10,11)(H,12,13)/t3-,4-,5-,8-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	8.00E+7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lilly, S.A. Curated by ChEMBL					Assay Description Inhibition of [3H]LY-341,495 binding to mGlu2 receptors of rat brain				J Med Chem 48: 5305-20 (2005) Article DOI: 10.1021/jm050235r BindingDB Entry DOI: 10.7270/Q2WM1F5W
					More data for this Ligand-Target Pair				3D Structure (crystal)
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50157059 ((S)-3-{4-[3-(4-Benzoyl-phenoxy)-propoxy]-phenyl}-2...) Show SMILES CO[C@@H](Cc1ccc(OCCCOc2ccc(cc2)C(=O)c2ccccc2)cc1)C(O)=O Show InChI InChI=1S/C26H26O6/c1-30-24(26(28)29)18-19-8-12-22(13-9-19)31-16-5-17-32-23-14-10-21(11-15-23)25(27)20-6-3-2-4-7-20/h2-4,6-15,24H,5,16-18H2,1H3,(H,28,29)/t24-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean inhibitory concentration against human peroxisome proliferator-activated receptor gamma				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50157055 ((S)-3-{4-[3-(4-Benzoyl-phenoxy)-propoxy]-3-chloro-...) Show SMILES CO[C@@H](Cc1ccc(OCCCOc2ccc(cc2)C(=O)c2ccccc2)c(Cl)c1)C(O)=O Show InChI InChI=1S/C26H25ClO6/c1-31-24(26(29)30)17-18-8-13-23(22(27)16-18)33-15-5-14-32-21-11-9-20(10-12-21)25(28)19-6-3-2-4-7-19/h2-4,6-13,16,24H,5,14-15,17H2,1H3,(H,29,30)/t24-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean inhibitory concentration against human peroxisome proliferator-activated receptor gamma				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50157057 ((S)-2-Methoxy-3-{4-[5-(4-phenoxy-phenoxy)-pent-1-y...) Show SMILES CO[C@@H](Cc1ccc(cc1)C#CCCCOc1ccc(Oc2ccccc2)cc1)C(O)=O Show InChI InChI=1S/C27H26O5/c1-30-26(27(28)29)20-22-13-11-21(12-14-22)8-4-3-7-19-31-23-15-17-25(18-16-23)32-24-9-5-2-6-10-24/h2,5-6,9-18,26H,3,7,19-20H2,1H3,(H,28,29)/t26-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean inhibitory concentration against human peroxisome proliferator-activated receptor gamma				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50157058 ((S)-2-Methoxy-3-{3-methoxy-4-[3-(4-phenoxy-phenoxy...) Show SMILES CO[C@@H](Cc1ccc(OCCCOc2ccc(Oc3ccccc3)cc2)c(OC)c1)C(O)=O Show InChI InChI=1S/C26H28O7/c1-29-24-17-19(18-25(30-2)26(27)28)9-14-23(24)32-16-6-15-31-20-10-12-22(13-11-20)33-21-7-4-3-5-8-21/h3-5,7-14,17,25H,6,15-16,18H2,1-2H3,(H,27,28)/t25-/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	13	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean inhibitory concentration against human peroxisome proliferator-activated receptor gamma				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50157060 ((S)-2-Methoxy-3-{4-[4-(4-phenoxy-phenoxy)-but-1-yn...) Show SMILES CO[C@@H](Cc1ccc(cc1)C#CCCOc1ccc(Oc2ccccc2)cc1)C(O)=O Show InChI InChI=1S/C26H24O5/c1-29-25(26(27)28)19-21-12-10-20(11-13-21)7-5-6-18-30-22-14-16-24(17-15-22)31-23-8-3-2-4-9-23/h2-4,8-17,25H,6,18-19H2,1H3,(H,27,28)/t25-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean inhibitory concentration against human peroxisome proliferator-activated receptor gamma				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50157061 ((S)-3-{4-[3-(Biphenyl-4-yloxy)-propoxy]-phenyl}-2-...) Show SMILES CO[C@@H](Cc1ccc(OCCCOc2ccc(cc2)-c2ccccc2)cc1)C(O)=O Show InChI InChI=1S/C25H26O5/c1-28-24(25(26)27)18-19-8-12-22(13-9-19)29-16-5-17-30-23-14-10-21(11-15-23)20-6-3-2-4-7-20/h2-4,6-15,24H,5,16-18H2,1H3,(H,26,27)/t24-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean inhibitory concentration against human peroxisome proliferator-activated receptor gamma				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50157056 ((S)-2-Methoxy-3-{4-[3-(4-phenoxy-phenoxy)-propoxy]...) Show SMILES CO[C@@H](Cc1ccc(OCCCOc2ccc(Oc3ccccc3)cc2)cc1)C(O)=O Show InChI InChI=1S/C25H26O6/c1-28-24(25(26)27)18-19-8-10-20(11-9-19)29-16-5-17-30-21-12-14-23(15-13-21)31-22-6-3-2-4-7-22/h2-4,6-15,24H,5,16-18H2,1H3,(H,26,27)/t24-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE 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
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean inhibitory concentration against human peroxisome proliferator-activated receptor gamma				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50157054 ((S)-2-Ethoxy-3-{4-[3-(4-phenoxy-phenoxy)-propoxy]-...) Show SMILES CCO[C@@H](Cc1ccc(OCCCOc2ccc(Oc3ccccc3)cc2)cc1)C(O)=O Show InChI InChI=1S/C26H28O6/c1-2-29-25(26(27)28)19-20-9-11-21(12-10-20)30-17-6-18-31-22-13-15-24(16-14-22)32-23-7-4-3-5-8-23/h3-5,7-16,25H,2,6,17-19H2,1H3,(H,27,28)/t25-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	44	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean inhibitory concentration against human peroxisome proliferator-activated receptor gamma				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM28681 (5-[(4-{2-[methyl(pyridin-2-yl)amino]ethoxy}phenyl)...) Show SMILES CN(CCOc1ccc(Cc2sc(=O)[nH]c2O)cc1)c1ccccn1 Show InChI InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,22H,10-12H2,1H3,(H,20,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean inhibitory concentration against human peroxisome proliferator-activated receptor gamma				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair				3D Structure (crystal)
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50157055 ((S)-3-{4-[3-(4-Benzoyl-phenoxy)-propoxy]-3-chloro-...) Show SMILES CO[C@@H](Cc1ccc(OCCCOc2ccc(cc2)C(=O)c2ccccc2)c(Cl)c1)C(O)=O Show InChI InChI=1S/C26H25ClO6/c1-31-24(26(29)30)17-18-8-13-23(22(27)16-18)33-15-5-14-32-21-11-9-20(10-12-21)25(28)19-6-3-2-4-7-19/h2-4,6-13,16,24H,5,14-15,17H2,1H3,(H,29,30)/t24-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	309	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean inhibitory concentration against human peroxisome proliferator activated receptor alpha				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50157059 ((S)-3-{4-[3-(4-Benzoyl-phenoxy)-propoxy]-phenyl}-2...) Show SMILES CO[C@@H](Cc1ccc(OCCCOc2ccc(cc2)C(=O)c2ccccc2)cc1)C(O)=O Show InChI InChI=1S/C26H26O6/c1-30-24(26(28)29)18-19-8-12-22(13-9-19)31-16-5-17-32-23-14-10-21(11-15-23)25(27)20-6-3-2-4-7-20/h2-4,6-15,24H,5,16-18H2,1H3,(H,28,29)/t24-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	470	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean inhibitory concentration against human peroxisome proliferator activated receptor alpha				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50157061 ((S)-3-{4-[3-(Biphenyl-4-yloxy)-propoxy]-phenyl}-2-...) Show SMILES CO[C@@H](Cc1ccc(OCCCOc2ccc(cc2)-c2ccccc2)cc1)C(O)=O Show InChI InChI=1S/C25H26O5/c1-28-24(25(26)27)18-19-8-12-22(13-9-19)29-16-5-17-30-23-14-10-21(11-15-23)20-6-3-2-4-7-20/h2-4,6-15,24H,5,16-18H2,1H3,(H,26,27)/t24-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	568	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean inhibitory concentration against human peroxisome proliferator activated receptor alpha				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50157057 ((S)-2-Methoxy-3-{4-[5-(4-phenoxy-phenoxy)-pent-1-y...) Show SMILES CO[C@@H](Cc1ccc(cc1)C#CCCCOc1ccc(Oc2ccccc2)cc1)C(O)=O Show InChI InChI=1S/C27H26O5/c1-30-26(27(28)29)20-22-13-11-21(12-14-22)8-4-3-7-19-31-23-15-17-25(18-16-23)32-24-9-5-2-6-10-24/h2,5-6,9-18,26H,3,7,19-20H2,1H3,(H,28,29)/t26-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	770	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean inhibitory concentration against human peroxisome proliferator activated receptor alpha				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50157060 ((S)-2-Methoxy-3-{4-[4-(4-phenoxy-phenoxy)-but-1-yn...) Show SMILES CO[C@@H](Cc1ccc(cc1)C#CCCOc1ccc(Oc2ccccc2)cc1)C(O)=O Show InChI InChI=1S/C26H24O5/c1-29-25(26(27)28)19-21-12-10-20(11-13-21)7-5-6-18-30-22-14-16-24(17-15-22)31-23-8-3-2-4-9-23/h2-4,8-17,25H,6,18-19H2,1H3,(H,27,28)/t25-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.15E+3	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean inhibitory concentration against human peroxisome proliferator activated receptor alpha				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50157058 ((S)-2-Methoxy-3-{3-methoxy-4-[3-(4-phenoxy-phenoxy...) Show SMILES CO[C@@H](Cc1ccc(OCCCOc2ccc(Oc3ccccc3)cc2)c(OC)c1)C(O)=O Show InChI InChI=1S/C26H28O7/c1-29-24-17-19(18-25(30-2)26(27)28)9-14-23(24)32-16-6-15-31-20-10-12-22(13-11-20)33-21-7-4-3-5-8-21/h3-5,7-14,17,25H,6,15-16,18H2,1-2H3,(H,27,28)/t25-/m0/s1	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
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean inhibitory concentration against human peroxisome proliferator activated receptor alpha				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50157061 ((S)-3-{4-[3-(Biphenyl-4-yloxy)-propoxy]-phenyl}-2-...) Show SMILES CO[C@@H](Cc1ccc(OCCCOc2ccc(cc2)-c2ccccc2)cc1)C(O)=O Show InChI InChI=1S/C25H26O5/c1-28-24(25(26)27)18-19-8-12-22(13-9-19)29-16-5-17-30-23-14-10-21(11-15-23)20-6-3-2-4-7-20/h2-4,6-15,24H,5,16-18H2,1H3,(H,26,27)/t24-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.39E+3	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean inhibitory concentration against human peroxisome proliferator-activated receptor delta				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50157055 ((S)-3-{4-[3-(4-Benzoyl-phenoxy)-propoxy]-3-chloro-...) Show SMILES CO[C@@H](Cc1ccc(OCCCOc2ccc(cc2)C(=O)c2ccccc2)c(Cl)c1)C(O)=O Show InChI InChI=1S/C26H25ClO6/c1-31-24(26(29)30)17-18-8-13-23(22(27)16-18)33-15-5-14-32-21-11-9-20(10-12-21)25(28)19-6-3-2-4-7-19/h2-4,6-13,16,24H,5,14-15,17H2,1H3,(H,29,30)/t24-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	1.51E+3	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean inhibitory concentration against human peroxisome proliferator-activated receptor delta				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50157054 ((S)-2-Ethoxy-3-{4-[3-(4-phenoxy-phenoxy)-propoxy]-...) Show SMILES CCO[C@@H](Cc1ccc(OCCCOc2ccc(Oc3ccccc3)cc2)cc1)C(O)=O Show InChI InChI=1S/C26H28O6/c1-2-29-25(26(27)28)19-20-9-11-21(12-10-20)30-17-6-18-31-22-13-15-24(16-14-22)32-23-7-4-3-5-8-23/h3-5,7-16,25H,2,6,17-19H2,1H3,(H,27,28)/t25-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.57E+3	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean inhibitory concentration against human peroxisome proliferator-activated receptor delta				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50157054 ((S)-2-Ethoxy-3-{4-[3-(4-phenoxy-phenoxy)-propoxy]-...) Show SMILES CCO[C@@H](Cc1ccc(OCCCOc2ccc(Oc3ccccc3)cc2)cc1)C(O)=O Show InChI InChI=1S/C26H28O6/c1-2-29-25(26(27)28)19-20-9-11-21(12-10-20)30-17-6-18-31-22-13-15-24(16-14-22)32-23-7-4-3-5-8-23/h3-5,7-16,25H,2,6,17-19H2,1H3,(H,27,28)/t25-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.69E+3	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean inhibitory concentration against human peroxisome proliferator activated receptor alpha				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50157056 ((S)-2-Methoxy-3-{4-[3-(4-phenoxy-phenoxy)-propoxy]...) Show SMILES CO[C@@H](Cc1ccc(OCCCOc2ccc(Oc3ccccc3)cc2)cc1)C(O)=O Show InChI InChI=1S/C25H26O6/c1-28-24(25(26)27)18-19-8-10-20(11-9-19)29-16-5-17-30-21-12-14-23(15-13-21)31-22-6-3-2-4-7-22/h2-4,6-15,24H,5,16-18H2,1H3,(H,26,27)/t24-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.92E+3	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean inhibitory concentration against human peroxisome proliferator-activated receptor delta				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50157059 ((S)-3-{4-[3-(4-Benzoyl-phenoxy)-propoxy]-phenyl}-2...) Show SMILES CO[C@@H](Cc1ccc(OCCCOc2ccc(cc2)C(=O)c2ccccc2)cc1)C(O)=O Show InChI InChI=1S/C26H26O6/c1-30-24(26(28)29)18-19-8-12-22(13-9-19)31-16-5-17-32-23-14-10-21(11-15-23)25(27)20-6-3-2-4-7-20/h2-4,6-15,24H,5,16-18H2,1H3,(H,28,29)/t24-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.32E+3	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean inhibitory concentration against human peroxisome proliferator-activated receptor delta				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50157056 ((S)-2-Methoxy-3-{4-[3-(4-phenoxy-phenoxy)-propoxy]...) Show SMILES CO[C@@H](Cc1ccc(OCCCOc2ccc(Oc3ccccc3)cc2)cc1)C(O)=O Show InChI InChI=1S/C25H26O6/c1-28-24(25(26)27)18-19-8-10-20(11-9-19)29-16-5-17-30-21-12-14-23(15-13-21)31-22-6-3-2-4-7-22/h2-4,6-15,24H,5,16-18H2,1H3,(H,26,27)/t24-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.71E+3	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean inhibitory concentration against human peroxisome proliferator activated receptor alpha				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50157060 ((S)-2-Methoxy-3-{4-[4-(4-phenoxy-phenoxy)-but-1-yn...) Show SMILES CO[C@@H](Cc1ccc(cc1)C#CCCOc1ccc(Oc2ccccc2)cc1)C(O)=O Show InChI InChI=1S/C26H24O5/c1-29-25(26(27)28)19-21-12-10-20(11-13-21)7-5-6-18-30-22-14-16-24(17-15-22)31-23-8-3-2-4-9-23/h2-4,8-17,25H,6,18-19H2,1H3,(H,27,28)/t25-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.94E+3	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean inhibitory concentration against human peroxisome proliferator-activated receptor delta				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50157057 ((S)-2-Methoxy-3-{4-[5-(4-phenoxy-phenoxy)-pent-1-y...) Show SMILES CO[C@@H](Cc1ccc(cc1)C#CCCCOc1ccc(Oc2ccccc2)cc1)C(O)=O Show InChI InChI=1S/C27H26O5/c1-30-26(27(28)29)20-22-13-11-21(12-14-22)8-4-3-7-19-31-23-15-17-25(18-16-23)32-24-9-5-2-6-10-24/h2,5-6,9-18,26H,3,7,19-20H2,1H3,(H,28,29)/t26-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4.12E+3	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean inhibitory concentration against human peroxisome proliferator-activated receptor delta				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50157058 ((S)-2-Methoxy-3-{3-methoxy-4-[3-(4-phenoxy-phenoxy...) Show SMILES CO[C@@H](Cc1ccc(OCCCOc2ccc(Oc3ccccc3)cc2)c(OC)c1)C(O)=O Show InChI InChI=1S/C26H28O7/c1-29-24-17-19(18-25(30-2)26(27)28)9-14-23(24)32-16-6-15-31-20-10-12-22(13-11-20)33-21-7-4-3-5-8-21/h3-5,7-14,17,25H,6,15-16,18H2,1-2H3,(H,27,28)/t25-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean inhibitory concentration against human peroxisome proliferator-activated receptor delta				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM28700 (2-(4-(4-Chlorobenzoyl)phenoxy)-2-methylpropionic a...) Show SMILES CC(C)(Oc1ccc(cc1)C(=O)c1ccc(Cl)cc1)C(O)=O Show InChI InChI=1S/C17H15ClO4/c1-17(2,16(20)21)22-14-9-5-12(6-10-14)15(19)11-3-7-13(18)8-4-11/h3-10H,1-2H3,(H,20,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean inhibitory concentration against human peroxisome proliferator-activated receptor gamma				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair				3D Structure (crystal)
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM28700 (2-(4-(4-Chlorobenzoyl)phenoxy)-2-methylpropionic a...) Show SMILES CC(C)(Oc1ccc(cc1)C(=O)c1ccc(Cl)cc1)C(O)=O Show InChI InChI=1S/C17H15ClO4/c1-17(2,16(20)21)22-14-9-5-12(6-10-14)15(19)11-3-7-13(18)8-4-11/h3-10H,1-2H3,(H,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean inhibitory concentration against human peroxisome proliferator activated receptor alpha				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair				3D Structure (crystal)
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM28681 (5-[(4-{2-[methyl(pyridin-2-yl)amino]ethoxy}phenyl)...) Show SMILES CN(CCOc1ccc(Cc2sc(=O)[nH]c2O)cc1)c1ccccn1 Show InChI InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,22H,10-12H2,1H3,(H,20,23)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean inhibitory concentration against human peroxisome proliferator activated receptor alpha				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50157055 ((S)-3-{4-[3-(4-Benzoyl-phenoxy)-propoxy]-3-chloro-...) Show SMILES CO[C@@H](Cc1ccc(OCCCOc2ccc(cc2)C(=O)c2ccccc2)c(Cl)c1)C(O)=O Show InChI InChI=1S/C26H25ClO6/c1-31-24(26(29)30)17-18-8-13-23(22(27)16-18)33-15-5-14-32-21-11-9-20(10-12-21)25(28)19-6-3-2-4-7-19/h2-4,6-13,16,24H,5,14-15,17H2,1H3,(H,29,30)/t24-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	n/a	n/a	305	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean effective concentration against human peroxisome proliferator-activated receptor gamma				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50157059 ((S)-3-{4-[3-(4-Benzoyl-phenoxy)-propoxy]-phenyl}-2...) Show SMILES CO[C@@H](Cc1ccc(OCCCOc2ccc(cc2)C(=O)c2ccccc2)cc1)C(O)=O Show InChI InChI=1S/C26H26O6/c1-30-24(26(28)29)18-19-8-12-22(13-9-19)31-16-5-17-32-23-14-10-21(11-15-23)25(27)20-6-3-2-4-7-20/h2-4,6-15,24H,5,16-18H2,1H3,(H,28,29)/t24-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	260	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean effective concentration against human peroxisome proliferator-activated receptor gamma				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM28700 (2-(4-(4-Chlorobenzoyl)phenoxy)-2-methylpropionic a...) Show SMILES CC(C)(Oc1ccc(cc1)C(=O)c1ccc(Cl)cc1)C(O)=O Show InChI InChI=1S/C17H15ClO4/c1-17(2,16(20)21)22-14-9-5-12(6-10-14)15(19)11-3-7-13(18)8-4-11/h3-10H,1-2H3,(H,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean effective concentration against human peroxisome proliferator activated receptor alpha				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair				3D Structure (crystal)
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM28681 (5-[(4-{2-[methyl(pyridin-2-yl)amino]ethoxy}phenyl)...) Show SMILES CN(CCOc1ccc(Cc2sc(=O)[nH]c2O)cc1)c1ccccn1 Show InChI InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,22H,10-12H2,1H3,(H,20,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	n/a	n/a	268	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean effective concentration against human peroxisome proliferator-activated receptor gamma				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair				3D Structure (crystal)
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50157060 ((S)-2-Methoxy-3-{4-[4-(4-phenoxy-phenoxy)-but-1-yn...) Show SMILES CO[C@@H](Cc1ccc(cc1)C#CCCOc1ccc(Oc2ccccc2)cc1)C(O)=O Show InChI InChI=1S/C26H24O5/c1-29-25(26(27)28)19-21-12-10-20(11-13-21)7-5-6-18-30-22-14-16-24(17-15-22)31-23-8-3-2-4-9-23/h2-4,8-17,25H,6,18-19H2,1H3,(H,27,28)/t25-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	103	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean effective concentration against human peroxisome proliferator-activated receptor gamma				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50157060 ((S)-2-Methoxy-3-{4-[4-(4-phenoxy-phenoxy)-but-1-yn...) Show SMILES CO[C@@H](Cc1ccc(cc1)C#CCCOc1ccc(Oc2ccccc2)cc1)C(O)=O Show InChI InChI=1S/C26H24O5/c1-29-25(26(27)28)19-21-12-10-20(11-13-21)7-5-6-18-30-22-14-16-24(17-15-22)31-23-8-3-2-4-9-23/h2-4,8-17,25H,6,18-19H2,1H3,(H,27,28)/t25-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	1.88E+3	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean effective concentration against human peroxisome proliferator activated receptor alpha				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50157056 ((S)-2-Methoxy-3-{4-[3-(4-phenoxy-phenoxy)-propoxy]...) Show SMILES CO[C@@H](Cc1ccc(OCCCOc2ccc(Oc3ccccc3)cc2)cc1)C(O)=O Show InChI InChI=1S/C25H26O6/c1-28-24(25(26)27)18-19-8-10-20(11-9-19)29-16-5-17-30-21-12-14-23(15-13-21)31-22-6-3-2-4-7-22/h2-4,6-15,24H,5,16-18H2,1H3,(H,26,27)/t24-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	2.82E+3	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean effective concentration against human peroxisome proliferator activated receptor alpha				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50157061 ((S)-3-{4-[3-(Biphenyl-4-yloxy)-propoxy]-phenyl}-2-...) Show SMILES CO[C@@H](Cc1ccc(OCCCOc2ccc(cc2)-c2ccccc2)cc1)C(O)=O Show InChI InChI=1S/C25H26O5/c1-28-24(25(26)27)18-19-8-12-22(13-9-19)29-16-5-17-30-23-14-10-21(11-15-23)20-6-3-2-4-7-20/h2-4,6-15,24H,5,16-18H2,1H3,(H,26,27)/t24-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	154	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean effective concentration against human peroxisome proliferator-activated receptor gamma				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50157061 ((S)-3-{4-[3-(Biphenyl-4-yloxy)-propoxy]-phenyl}-2-...) Show SMILES CO[C@@H](Cc1ccc(OCCCOc2ccc(cc2)-c2ccccc2)cc1)C(O)=O Show InChI InChI=1S/C25H26O5/c1-28-24(25(26)27)18-19-8-12-22(13-9-19)29-16-5-17-30-23-14-10-21(11-15-23)20-6-3-2-4-7-20/h2-4,6-15,24H,5,16-18H2,1H3,(H,26,27)/t24-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean effective concentration against human peroxisome proliferator activated receptor alpha				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50157058 ((S)-2-Methoxy-3-{3-methoxy-4-[3-(4-phenoxy-phenoxy...) Show SMILES CO[C@@H](Cc1ccc(OCCCOc2ccc(Oc3ccccc3)cc2)c(OC)c1)C(O)=O Show InChI InChI=1S/C26H28O7/c1-29-24-17-19(18-25(30-2)26(27)28)9-14-23(24)32-16-6-15-31-20-10-12-22(13-11-20)33-21-7-4-3-5-8-21/h3-5,7-14,17,25H,6,15-16,18H2,1-2H3,(H,27,28)/t25-/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	185	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean effective concentration against human peroxisome proliferator-activated receptor gamma				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50157058 ((S)-2-Methoxy-3-{3-methoxy-4-[3-(4-phenoxy-phenoxy...) Show SMILES CO[C@@H](Cc1ccc(OCCCOc2ccc(Oc3ccccc3)cc2)c(OC)c1)C(O)=O Show InChI InChI=1S/C26H28O7/c1-29-24-17-19(18-25(30-2)26(27)28)9-14-23(24)32-16-6-15-31-20-10-12-22(13-11-20)33-21-7-4-3-5-8-21/h3-5,7-14,17,25H,6,15-16,18H2,1-2H3,(H,27,28)/t25-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	2.15E+3	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean effective concentration against human peroxisome proliferator activated receptor alpha				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50157059 ((S)-3-{4-[3-(4-Benzoyl-phenoxy)-propoxy]-phenyl}-2...) Show SMILES CO[C@@H](Cc1ccc(OCCCOc2ccc(cc2)C(=O)c2ccccc2)cc1)C(O)=O Show InChI InChI=1S/C26H26O6/c1-30-24(26(28)29)18-19-8-12-22(13-9-19)31-16-5-17-32-23-14-10-21(11-15-23)25(27)20-6-3-2-4-7-20/h2-4,6-15,24H,5,16-18H2,1H3,(H,28,29)/t24-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	2.87E+3	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean effective concentration against human peroxisome proliferator activated receptor alpha				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50157057 ((S)-2-Methoxy-3-{4-[5-(4-phenoxy-phenoxy)-pent-1-y...) Show SMILES CO[C@@H](Cc1ccc(cc1)C#CCCCOc1ccc(Oc2ccccc2)cc1)C(O)=O Show InChI InChI=1S/C27H26O5/c1-30-26(27(28)29)20-22-13-11-21(12-14-22)8-4-3-7-19-31-23-15-17-25(18-16-23)32-24-9-5-2-6-10-24/h2,5-6,9-18,26H,3,7,19-20H2,1H3,(H,28,29)/t26-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	239	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean effective concentration against human peroxisome proliferator-activated receptor gamma				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50157054 ((S)-2-Ethoxy-3-{4-[3-(4-phenoxy-phenoxy)-propoxy]-...) Show SMILES CCO[C@@H](Cc1ccc(OCCCOc2ccc(Oc3ccccc3)cc2)cc1)C(O)=O Show InChI InChI=1S/C26H28O6/c1-2-29-25(26(27)28)19-20-9-11-21(12-10-20)30-17-6-18-31-22-13-15-24(16-14-22)32-23-7-4-3-5-8-23/h3-5,7-16,25H,2,6,17-19H2,1H3,(H,27,28)/t25-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	2.75E+3	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean effective concentration against human peroxisome proliferator activated receptor alpha				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50157056 ((S)-2-Methoxy-3-{4-[3-(4-phenoxy-phenoxy)-propoxy]...) Show SMILES CO[C@@H](Cc1ccc(OCCCOc2ccc(Oc3ccccc3)cc2)cc1)C(O)=O Show InChI InChI=1S/C25H26O6/c1-28-24(25(26)27)18-19-8-10-20(11-9-19)29-16-5-17-30-21-12-14-23(15-13-21)31-22-6-3-2-4-7-22/h2-4,6-15,24H,5,16-18H2,1H3,(H,26,27)/t24-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	361	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Mean effective concentration against human peroxisome proliferator-activated receptor gamma				Bioorg Med Chem Lett 15: 51-5 (2004) Article DOI: 10.1016/j.bmcl.2004.10.042 BindingDB Entry DOI: 10.7270/Q24B30T6
					More data for this Ligand-Target Pair

Displayed 1 to 50 (of 53 total )  |  Next  |  Last  >>

Jump to: