Compile Data Set for Download or QSAR

Found 27 hits with Last Name = 'recinella' and Initial = 'l'   

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))	BDBM50535430 (CHEMBL4592451) Show SMILES COc1ccc(cc1)\N=N\c1ccc(OCCc2ccc(OC(C)(C)C(O)=O)cc2)cc1 Show InChI InChI=1S/C25H26N2O5/c1-25(2,24(28)29)32-23-10-4-18(5-11-23)16-17-31-22-14-8-20(9-15-22)27-26-19-6-12-21(30-3)13-7-19/h4-15H,16-17H2,1-3H3,(H,28,29)/b27-26+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a
University of Chieti "G. d.Annunzio" Curated by ChEMBL					Assay Description Transactivation of GAL4-tagged human PPARalpha LBD expressed in human HepG2 cells at 100 nM to 100 uM incubated for 20 to 22 hrs by luciferase report...				ACS Med Chem Lett 10: 545-551 (2019) Article DOI: 10.1021/acsmedchemlett.8b00574 BindingDB Entry DOI: 10.7270/Q2QZ2FG6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50535438 (CHEMBL4471853) Show SMILES CC(C)(Oc1ccc(CCOc2ccc(cc2)\N=N\c2ccc(Cl)cc2)cc1)C(O)=O Show InChI InChI=1S/C24H23ClN2O4/c1-24(2,23(28)29)31-22-11-3-17(4-12-22)15-16-30-21-13-9-20(10-14-21)27-26-19-7-5-18(25)6-8-19/h3-14H,15-16H2,1-2H3,(H,28,29)/b27-26+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	380	n/a	n/a	n/a	n/a
University of Chieti "G. d.Annunzio" Curated by ChEMBL					Assay Description Transactivation of GAL4-tagged human PPARalpha LBD expressed in human HepG2 cells at 100 nM to 100 uM incubated for 20 to 22 hrs by luciferase report...				ACS Med Chem Lett 10: 545-551 (2019) Article DOI: 10.1021/acsmedchemlett.8b00574 BindingDB Entry DOI: 10.7270/Q2QZ2FG6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM28699 (2-(4-chlorophenoxy)-2-methylpropanoic acid | CHEMB...) Show SMILES CC(C)(Oc1ccc(Cl)cc1)C(O)=O Show InChI InChI=1S/C10H11ClO3/c1-10(2,9(12)13)14-8-5-3-7(11)4-6-8/h3-6H,1-2H3,(H,12,13)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	n/a	n/a	5.00E+4	n/a	n/a	n/a	n/a
University of Chieti "G. d.Annunzio" Curated by ChEMBL					Assay Description Transactivation of GAL4-tagged human PPARalpha LBD expressed in human HepG2 cells at 100 nM to 100 uM incubated for 20 to 22 hrs by luciferase report...				ACS Med Chem Lett 10: 545-551 (2019) Article DOI: 10.1021/acsmedchemlett.8b00574 BindingDB Entry DOI: 10.7270/Q2QZ2FG6
					More data for this Ligand-Target Pair				3D Structure (crystal)
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50535431 (CHEMBL4557173) Show SMILES CC(C)(Oc1ccc(OCCc2ccc(cc2)\N=N\c2ccc(cc2)C#N)cc1)C(O)=O Show InChI InChI=1S/C25H23N3O4/c1-25(2,24(29)30)32-23-13-11-22(12-14-23)31-16-15-18-3-7-20(8-4-18)27-28-21-9-5-19(17-26)6-10-21/h3-14H,15-16H2,1-2H3,(H,29,30)/b28-27+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a
University of Chieti "G. d.Annunzio" Curated by ChEMBL					Assay Description Transactivation of GAL4-tagged human PPARalpha LBD expressed in human HepG2 cells at 100 nM to 100 uM incubated for 20 to 22 hrs by luciferase report...				ACS Med Chem Lett 10: 545-551 (2019) Article DOI: 10.1021/acsmedchemlett.8b00574 BindingDB Entry DOI: 10.7270/Q2QZ2FG6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50535432 (CHEMBL4533822) Show SMILES CC(C)(Oc1ccc(OCCc2ccc(cc2)\N=N\c2ccc(Br)cc2)cc1)C(O)=O Show InChI InChI=1S/C24H23BrN2O4/c1-24(2,23(28)29)31-22-13-11-21(12-14-22)30-16-15-17-3-7-19(8-4-17)26-27-20-9-5-18(25)6-10-20/h3-14H,15-16H2,1-2H3,(H,28,29)/b27-26+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a
University of Chieti "G. d.Annunzio" Curated by ChEMBL					Assay Description Transactivation of GAL4-tagged human PPARalpha LBD expressed in human HepG2 cells at 100 nM to 100 uM incubated for 20 to 22 hrs by luciferase report...				ACS Med Chem Lett 10: 545-551 (2019) Article DOI: 10.1021/acsmedchemlett.8b00574 BindingDB Entry DOI: 10.7270/Q2QZ2FG6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50535433 (CHEMBL4461949) Show SMILES CC(C)(Oc1ccc(OCCc2ccc(cc2)\N=N\c2ccc(Cl)cc2)cc1)C(O)=O Show InChI InChI=1S/C24H23ClN2O4/c1-24(2,23(28)29)31-22-13-11-21(12-14-22)30-16-15-17-3-7-19(8-4-17)26-27-20-9-5-18(25)6-10-20/h3-14H,15-16H2,1-2H3,(H,28,29)/b27-26+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	510	n/a	n/a	n/a	n/a
University of Chieti "G. d.Annunzio" Curated by ChEMBL					Assay Description Transactivation of GAL4-tagged human PPARalpha LBD expressed in human HepG2 cells at 100 nM to 100 uM incubated for 20 to 22 hrs by luciferase report...				ACS Med Chem Lett 10: 545-551 (2019) Article DOI: 10.1021/acsmedchemlett.8b00574 BindingDB Entry DOI: 10.7270/Q2QZ2FG6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50535434 (CHEMBL4445737) Show SMILES CC(C)(Oc1ccc(CCOc2ccc(cc2)\N=N\c2ccc(cc2)C(F)(F)F)cc1)C(O)=O Show InChI InChI=1S/C25H23F3N2O4/c1-24(2,23(31)32)34-22-11-3-17(4-12-22)15-16-33-21-13-9-20(10-14-21)30-29-19-7-5-18(6-8-19)25(26,27)28/h3-14H,15-16H2,1-2H3,(H,31,32)/b30-29+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.30E+3	n/a	n/a	n/a	n/a
University of Chieti "G. d.Annunzio" Curated by ChEMBL					Assay Description Transactivation of GAL4-tagged human PPARalpha LBD expressed in human HepG2 cells at 100 nM to 100 uM incubated for 20 to 22 hrs by luciferase report...				ACS Med Chem Lett 10: 545-551 (2019) Article DOI: 10.1021/acsmedchemlett.8b00574 BindingDB Entry DOI: 10.7270/Q2QZ2FG6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50535435 (CHEMBL4453610) Show SMILES CC(C)(Oc1ccc(CCOc2ccc(cc2)\N=N\c2ccc(Br)cc2)cc1)C(O)=O Show InChI InChI=1S/C24H23BrN2O4/c1-24(2,23(28)29)31-22-11-3-17(4-12-22)15-16-30-21-13-9-20(10-14-21)27-26-19-7-5-18(25)6-8-19/h3-14H,15-16H2,1-2H3,(H,28,29)/b27-26+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	810	n/a	n/a	n/a	n/a
University of Chieti "G. d.Annunzio" Curated by ChEMBL					Assay Description Transactivation of GAL4-tagged human PPARalpha LBD expressed in human HepG2 cells at 100 nM to 100 uM incubated for 20 to 22 hrs by luciferase report...				ACS Med Chem Lett 10: 545-551 (2019) Article DOI: 10.1021/acsmedchemlett.8b00574 BindingDB Entry DOI: 10.7270/Q2QZ2FG6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50535432 (CHEMBL4533822) Show SMILES CC(C)(Oc1ccc(OCCc2ccc(cc2)\N=N\c2ccc(Br)cc2)cc1)C(O)=O Show InChI InChI=1S/C24H23BrN2O4/c1-24(2,23(28)29)31-22-13-11-21(12-14-22)30-16-15-17-3-7-19(8-4-17)26-27-20-9-5-18(25)6-10-20/h3-14H,15-16H2,1-2H3,(H,28,29)/b27-26+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a
University of Chieti "G. d.Annunzio" Curated by ChEMBL					Assay Description Transactivation of GAL4-tagged human PPARdelta LBD expressed in human HepG2 cells at 100 nM to 100 uM incubated for 20 to 22 hrs by luciferase report...				ACS Med Chem Lett 10: 545-551 (2019) Article DOI: 10.1021/acsmedchemlett.8b00574 BindingDB Entry DOI: 10.7270/Q2QZ2FG6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50535436 (CHEMBL4449760) Show SMILES CC(C)(Oc1ccc(OCCc2ccc(cc2)\N=N\c2ccccc2)cc1)C(O)=O Show InChI InChI=1S/C24H24N2O4/c1-24(2,23(27)28)30-22-14-12-21(13-15-22)29-17-16-18-8-10-20(11-9-18)26-25-19-6-4-3-5-7-19/h3-15H,16-17H2,1-2H3,(H,27,28)/b26-25+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.80E+3	n/a	n/a	n/a	n/a
University of Chieti "G. d.Annunzio" Curated by ChEMBL					Assay Description Transactivation of GAL4-tagged human PPARdelta LBD expressed in human HepG2 cells at 100 nM to 100 uM incubated for 20 to 22 hrs by luciferase report...				ACS Med Chem Lett 10: 545-551 (2019) Article DOI: 10.1021/acsmedchemlett.8b00574 BindingDB Entry DOI: 10.7270/Q2QZ2FG6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50535437 (CHEMBL4580572) Show SMILES CC(C)(Oc1ccc(CCOc2ccc(cc2)\N=N\c2ccc(cc2)[N+]([O-])=O)cc1)C(O)=O Show InChI InChI=1S/C24H23N3O6/c1-24(2,23(28)29)33-22-11-3-17(4-12-22)15-16-32-21-13-7-19(8-14-21)26-25-18-5-9-20(10-6-18)27(30)31/h3-14H,15-16H2,1-2H3,(H,28,29)/b26-25+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	4.10E+3	n/a	n/a	n/a	n/a
University of Chieti "G. d.Annunzio" Curated by ChEMBL					Assay Description Transactivation of GAL4-tagged human PPARdelta LBD expressed in human HepG2 cells at 100 nM to 100 uM incubated for 20 to 22 hrs by luciferase report...				ACS Med Chem Lett 10: 545-551 (2019) Article DOI: 10.1021/acsmedchemlett.8b00574 BindingDB Entry DOI: 10.7270/Q2QZ2FG6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50535434 (CHEMBL4445737) Show SMILES CC(C)(Oc1ccc(CCOc2ccc(cc2)\N=N\c2ccc(cc2)C(F)(F)F)cc1)C(O)=O Show InChI InChI=1S/C25H23F3N2O4/c1-24(2,23(31)32)34-22-11-3-17(4-12-22)15-16-33-21-13-9-20(10-14-21)30-29-19-7-5-18(6-8-19)25(26,27)28/h3-14H,15-16H2,1-2H3,(H,31,32)/b30-29+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.80E+3	n/a	n/a	n/a	n/a
University of Chieti "G. d.Annunzio" Curated by ChEMBL					Assay Description Transactivation of GAL4-tagged human PPARdelta LBD expressed in human HepG2 cells at 100 nM to 100 uM incubated for 20 to 22 hrs by luciferase report...				ACS Med Chem Lett 10: 545-551 (2019) Article DOI: 10.1021/acsmedchemlett.8b00574 BindingDB Entry DOI: 10.7270/Q2QZ2FG6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50535438 (CHEMBL4471853) Show SMILES CC(C)(Oc1ccc(CCOc2ccc(cc2)\N=N\c2ccc(Cl)cc2)cc1)C(O)=O Show InChI InChI=1S/C24H23ClN2O4/c1-24(2,23(28)29)31-22-11-3-17(4-12-22)15-16-30-21-13-9-20(10-14-21)27-26-19-7-5-18(25)6-8-19/h3-14H,15-16H2,1-2H3,(H,28,29)/b27-26+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	3.10E+3	n/a	n/a	n/a	n/a
University of Chieti "G. d.Annunzio" Curated by ChEMBL					Assay Description Transactivation of GAL4-tagged human PPARdelta LBD expressed in human HepG2 cells at 100 nM to 100 uM incubated for 20 to 22 hrs by luciferase report...				ACS Med Chem Lett 10: 545-551 (2019) Article DOI: 10.1021/acsmedchemlett.8b00574 BindingDB Entry DOI: 10.7270/Q2QZ2FG6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50401993 (CHEMBL2204696) Show SMILES CC(C)(Oc1ccc(CCOc2ccc(cc2)\N=N\c2ccccc2)cc1)C(O)=O Show InChI InChI=1S/C24H24N2O4/c1-24(2,23(27)28)30-22-12-8-18(9-13-22)16-17-29-21-14-10-20(11-15-21)26-25-19-6-4-3-5-7-19/h3-15H,16-17H2,1-2H3,(H,27,28)/b26-25+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	6.40E+3	n/a	n/a	n/a	n/a
University of Chieti "G. d.Annunzio" Curated by ChEMBL					Assay Description Transactivation of GAL4-tagged human PPARdelta LBD expressed in human HepG2 cells at 100 nM to 100 uM incubated for 20 to 22 hrs by luciferase report...				ACS Med Chem Lett 10: 545-551 (2019) Article DOI: 10.1021/acsmedchemlett.8b00574 BindingDB Entry DOI: 10.7270/Q2QZ2FG6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50535436 (CHEMBL4449760) Show SMILES CC(C)(Oc1ccc(OCCc2ccc(cc2)\N=N\c2ccccc2)cc1)C(O)=O Show InChI InChI=1S/C24H24N2O4/c1-24(2,23(27)28)30-22-14-12-21(13-15-22)29-17-16-18-8-10-20(11-9-18)26-25-19-6-4-3-5-7-19/h3-15H,16-17H2,1-2H3,(H,27,28)/b26-25+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	6.00E+3	n/a	n/a	n/a	n/a
University of Chieti "G. d.Annunzio" Curated by ChEMBL					Assay Description Transactivation of GAL4-tagged human PPARgamma LBD expressed in human HepG2 cells at 100 nM to 100 uM incubated for 20 to 22 hrs by luciferase report...				ACS Med Chem Lett 10: 545-551 (2019) Article DOI: 10.1021/acsmedchemlett.8b00574 BindingDB Entry DOI: 10.7270/Q2QZ2FG6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50535439 (CHEMBL4444322) Show SMILES CC(C)(Oc1ccc(OCCc2ccc(cc2)\N=N\c2ccc(cc2)[N+]([O-])=O)cc1)C(O)=O Show InChI InChI=1S/C24H23N3O6/c1-24(2,23(28)29)33-22-13-11-21(12-14-22)32-16-15-17-3-5-18(6-4-17)25-26-19-7-9-20(10-8-19)27(30)31/h3-14H,15-16H2,1-2H3,(H,28,29)/b26-25+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.30E+3	n/a	n/a	n/a	n/a
University of Chieti "G. d.Annunzio" Curated by ChEMBL					Assay Description Transactivation of GAL4-tagged human PPARdelta LBD expressed in human HepG2 cells at 100 nM to 100 uM incubated for 20 to 22 hrs by luciferase report...				ACS Med Chem Lett 10: 545-551 (2019) Article DOI: 10.1021/acsmedchemlett.8b00574 BindingDB Entry DOI: 10.7270/Q2QZ2FG6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50085041 (2-(4-(3-(4-acetyl-3-hydroxy-2-propylphenoxy)propox...) Show SMILES CCCc1c(O)c(ccc1OCCCOc1ccc(OCC(O)=O)cc1)C(C)=O Show InChI InChI=1S/C22H26O7/c1-3-5-19-20(11-10-18(15(2)23)22(19)26)28-13-4-12-27-16-6-8-17(9-7-16)29-14-21(24)25/h6-11,26H,3-5,12-14H2,1-2H3,(H,24,25)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	n/a	n/a	210	n/a	n/a	n/a	n/a
University of Chieti "G. d.Annunzio" Curated by ChEMBL					Assay Description Transactivation of GAL4-tagged human PPARdelta LBD expressed in human HepG2 cells at 100 nM to 100 uM incubated for 20 to 22 hrs by luciferase report...				ACS Med Chem Lett 10: 545-551 (2019) Article DOI: 10.1021/acsmedchemlett.8b00574 BindingDB Entry DOI: 10.7270/Q2QZ2FG6
					More data for this Ligand-Target Pair				3D Structure (crystal)
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50535440 (CHEMBL4438226) Show SMILES CC(C)(Oc1ccc(OCCc2ccc(cc2)\N=N\c2ccc(cc2)C(F)(F)F)cc1)C(O)=O Show InChI InChI=1S/C25H23F3N2O4/c1-24(2,23(31)32)34-22-13-11-21(12-14-22)33-16-15-17-3-7-19(8-4-17)29-30-20-9-5-18(6-10-20)25(26,27)28/h3-14H,15-16H2,1-2H3,(H,31,32)/b30-29+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a
University of Chieti "G. d.Annunzio" Curated by ChEMBL					Assay Description Transactivation of GAL4-tagged human PPARalpha LBD expressed in human HepG2 cells at 100 nM to 100 uM incubated for 20 to 22 hrs by luciferase report...				ACS Med Chem Lett 10: 545-551 (2019) Article DOI: 10.1021/acsmedchemlett.8b00574 BindingDB Entry DOI: 10.7270/Q2QZ2FG6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50535441 (CHEMBL4461490) Show SMILES CC(C)(Oc1ccc(CCOc2ccc(cc2)\N=N\c2ccc(cc2)C#N)cc1)C(O)=O Show InChI InChI=1S/C25H23N3O4/c1-25(2,24(29)30)32-23-11-5-18(6-12-23)15-16-31-22-13-9-21(10-14-22)28-27-20-7-3-19(17-26)4-8-20/h3-14H,15-16H2,1-2H3,(H,29,30)/b28-27+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.60E+3	n/a	n/a	n/a	n/a
University of Chieti "G. d.Annunzio" Curated by ChEMBL					Assay Description Transactivation of GAL4-tagged human PPARalpha LBD expressed in human HepG2 cells at 100 nM to 100 uM incubated for 20 to 22 hrs by luciferase report...				ACS Med Chem Lett 10: 545-551 (2019) Article DOI: 10.1021/acsmedchemlett.8b00574 BindingDB Entry DOI: 10.7270/Q2QZ2FG6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50535433 (CHEMBL4461949) Show SMILES CC(C)(Oc1ccc(OCCc2ccc(cc2)\N=N\c2ccc(Cl)cc2)cc1)C(O)=O Show InChI InChI=1S/C24H23ClN2O4/c1-24(2,23(28)29)31-22-13-11-21(12-14-22)30-16-15-17-3-7-19(8-4-17)26-27-20-9-5-18(25)6-10-20/h3-14H,15-16H2,1-2H3,(H,28,29)/b27-26+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a
University of Chieti "G. d.Annunzio" Curated by ChEMBL					Assay Description Transactivation of GAL4-tagged human PPARdelta LBD expressed in human HepG2 cells at 100 nM to 100 uM incubated for 20 to 22 hrs by luciferase report...				ACS Med Chem Lett 10: 545-551 (2019) Article DOI: 10.1021/acsmedchemlett.8b00574 BindingDB Entry DOI: 10.7270/Q2QZ2FG6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50535441 (CHEMBL4461490) Show SMILES CC(C)(Oc1ccc(CCOc2ccc(cc2)\N=N\c2ccc(cc2)C#N)cc1)C(O)=O Show InChI InChI=1S/C25H23N3O4/c1-25(2,24(29)30)32-23-11-5-18(6-12-23)15-16-31-22-13-9-21(10-14-22)28-27-20-7-3-19(17-26)4-8-20/h3-14H,15-16H2,1-2H3,(H,29,30)/b28-27+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	6.50E+3	n/a	n/a	n/a	n/a
University of Chieti "G. d.Annunzio" Curated by ChEMBL					Assay Description Transactivation of GAL4-tagged human PPARdelta LBD expressed in human HepG2 cells at 100 nM to 100 uM incubated for 20 to 22 hrs by luciferase report...				ACS Med Chem Lett 10: 545-551 (2019) Article DOI: 10.1021/acsmedchemlett.8b00574 BindingDB Entry DOI: 10.7270/Q2QZ2FG6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50030474 (Avandamet | Avandaryl | Avandia | BRL-49653 | CHEB...) Show SMILES CN(CCOc1ccc(CC2SC(=O)NC2=O)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/h2-9,15H,10-12H2,1H3,(H,20,22,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase DrugBank MCE PC cid PC sid PDB UniChem Similars	DrugBank PDB Article PubMed	n/a	n/a	n/a	n/a	40	n/a	n/a	n/a	n/a
University of Chieti "G. d.Annunzio" Curated by ChEMBL					Assay Description Transactivation of GAL4-tagged human PPARgamma LBD expressed in human HepG2 cells at 100 nM to 100 uM incubated for 20 to 22 hrs by luciferase report...				ACS Med Chem Lett 10: 545-551 (2019) Article DOI: 10.1021/acsmedchemlett.8b00574 BindingDB Entry DOI: 10.7270/Q2QZ2FG6
					More data for this Ligand-Target Pair				3D Structure (crystal)
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50535431 (CHEMBL4557173) Show SMILES CC(C)(Oc1ccc(OCCc2ccc(cc2)\N=N\c2ccc(cc2)C#N)cc1)C(O)=O Show InChI InChI=1S/C25H23N3O4/c1-25(2,24(29)30)32-23-13-11-22(12-14-23)31-16-15-18-3-7-20(8-4-18)27-28-21-9-5-19(17-26)6-10-21/h3-14H,15-16H2,1-2H3,(H,29,30)/b28-27+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.80E+3	n/a	n/a	n/a	n/a
University of Chieti "G. d.Annunzio" Curated by ChEMBL					Assay Description Transactivation of GAL4-tagged human PPARdelta LBD expressed in human HepG2 cells at 100 nM to 100 uM incubated for 20 to 22 hrs by luciferase report...				ACS Med Chem Lett 10: 545-551 (2019) Article DOI: 10.1021/acsmedchemlett.8b00574 BindingDB Entry DOI: 10.7270/Q2QZ2FG6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50535436 (CHEMBL4449760) Show SMILES CC(C)(Oc1ccc(OCCc2ccc(cc2)\N=N\c2ccccc2)cc1)C(O)=O Show InChI InChI=1S/C24H24N2O4/c1-24(2,23(27)28)30-22-14-12-21(13-15-22)29-17-16-18-8-10-20(11-9-18)26-25-19-6-4-3-5-7-19/h3-15H,16-17H2,1-2H3,(H,27,28)/b26-25+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	250	n/a	n/a	n/a	n/a
University of Chieti "G. d.Annunzio" Curated by ChEMBL					Assay Description Transactivation of GAL4-tagged human PPARalpha LBD expressed in human HepG2 cells at 100 nM to 100 uM incubated for 20 to 22 hrs by luciferase report...				ACS Med Chem Lett 10: 545-551 (2019) Article DOI: 10.1021/acsmedchemlett.8b00574 BindingDB Entry DOI: 10.7270/Q2QZ2FG6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50401993 (CHEMBL2204696) Show SMILES CC(C)(Oc1ccc(CCOc2ccc(cc2)\N=N\c2ccccc2)cc1)C(O)=O Show InChI InChI=1S/C24H24N2O4/c1-24(2,23(27)28)30-22-12-8-18(9-13-22)16-17-29-21-14-10-20(11-15-21)26-25-19-6-4-3-5-7-19/h3-15H,16-17H2,1-2H3,(H,27,28)/b26-25+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	n/a	n/a	2.10E+3	n/a	n/a	n/a	n/a
University of Chieti "G. d.Annunzio" Curated by ChEMBL					Assay Description Transactivation of GAL4-tagged human PPARalpha LBD expressed in human HepG2 cells at 100 nM to 100 uM incubated for 20 to 22 hrs by luciferase report...				ACS Med Chem Lett 10: 545-551 (2019) Article DOI: 10.1021/acsmedchemlett.8b00574 BindingDB Entry DOI: 10.7270/Q2QZ2FG6
					More data for this Ligand-Target Pair				3D Structure (crystal)
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50535435 (CHEMBL4453610) Show SMILES CC(C)(Oc1ccc(CCOc2ccc(cc2)\N=N\c2ccc(Br)cc2)cc1)C(O)=O Show InChI InChI=1S/C24H23BrN2O4/c1-24(2,23(28)29)31-22-11-3-17(4-12-22)15-16-30-21-13-9-20(10-14-21)27-26-19-7-5-18(25)6-8-19/h3-14H,15-16H2,1-2H3,(H,28,29)/b27-26+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	3.90E+3	n/a	n/a	n/a	n/a
University of Chieti "G. d.Annunzio" Curated by ChEMBL					Assay Description Transactivation of GAL4-tagged human PPARdelta LBD expressed in human HepG2 cells at 100 nM to 100 uM incubated for 20 to 22 hrs by luciferase report...				ACS Med Chem Lett 10: 545-551 (2019) Article DOI: 10.1021/acsmedchemlett.8b00574 BindingDB Entry DOI: 10.7270/Q2QZ2FG6
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50535430 (CHEMBL4592451) Show SMILES COc1ccc(cc1)\N=N\c1ccc(OCCc2ccc(OC(C)(C)C(O)=O)cc2)cc1 Show InChI InChI=1S/C25H26N2O5/c1-25(2,24(28)29)32-23-10-4-18(5-11-23)16-17-31-22-14-8-20(9-15-22)27-26-19-6-12-21(30-3)13-7-19/h4-15H,16-17H2,1-3H3,(H,28,29)/b27-26+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a
University of Chieti "G. d.Annunzio" Curated by ChEMBL					Assay Description Transactivation of GAL4-tagged human PPARdelta LBD expressed in human HepG2 cells at 100 nM to 100 uM incubated for 20 to 22 hrs by luciferase report...				ACS Med Chem Lett 10: 545-551 (2019) Article DOI: 10.1021/acsmedchemlett.8b00574 BindingDB Entry DOI: 10.7270/Q2QZ2FG6
					More data for this Ligand-Target Pair