null

SMILES: Cc1ccc(Cn2nc(CCCc3ccc(OC(C)(C)C(O)=O)cc3)n(CCO)c2=O)cc1

InChI Key: InChIKey=YUKWDLIKAHBTHE-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 50135779   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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))	BDBM50135779 (2-(4-{3-[4-(2-Hydroxy-ethyl)-1-(4-methyl-benzyl)-5...) Show SMILES Cc1ccc(Cn2nc(CCCc3ccc(OC(C)(C)C(O)=O)cc3)n(CCO)c2=O)cc1 Show InChI InChI=1S/C25H31N3O5/c1-18-7-9-20(10-8-18)17-28-24(32)27(15-16-29)22(26-28)6-4-5-19-11-13-21(14-12-19)33-25(2,3)23(30)31/h7-14,29H,4-6,15-17H2,1-3H3,(H,30,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	88	n/a	n/a	n/a	n/a
Division of Eli Lilly & Company Curated by ChEMBL					Assay Description Cotransfection activity against human Peroxisome proliferator activated receptor alpha				J Med Chem 46: 5121-4 (2003) Article DOI: 10.1021/jm034173l BindingDB Entry DOI: 10.7270/Q2D50MB0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50135779 (2-(4-{3-[4-(2-Hydroxy-ethyl)-1-(4-methyl-benzyl)-5...) Show SMILES Cc1ccc(Cn2nc(CCCc3ccc(OC(C)(C)C(O)=O)cc3)n(CCO)c2=O)cc1 Show InChI InChI=1S/C25H31N3O5/c1-18-7-9-20(10-8-18)17-28-24(32)27(15-16-29)22(26-28)6-4-5-19-11-13-21(14-12-19)33-25(2,3)23(30)31/h7-14,29H,4-6,15-17H2,1-3H3,(H,30,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	27	n/a	n/a	n/a	n/a	n/a	n/a
Division of Eli Lilly & Company Curated by ChEMBL					Assay Description Inhibitory activity against human Peroxisome proliferator activated receptor alpha				J Med Chem 46: 5121-4 (2003) Article DOI: 10.1021/jm034173l BindingDB Entry DOI: 10.7270/Q2D50MB0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50135779 (2-(4-{3-[4-(2-Hydroxy-ethyl)-1-(4-methyl-benzyl)-5...) Show SMILES Cc1ccc(Cn2nc(CCCc3ccc(OC(C)(C)C(O)=O)cc3)n(CCO)c2=O)cc1 Show InChI InChI=1S/C25H31N3O5/c1-18-7-9-20(10-8-18)17-28-24(32)27(15-16-29)22(26-28)6-4-5-19-11-13-21(14-12-19)33-25(2,3)23(30)31/h7-14,29H,4-6,15-17H2,1-3H3,(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	6.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Division of Eli Lilly & Company Curated by ChEMBL					Assay Description Inhibitory activity of compound against the binding of human Peroxisome proliferator activated receptor gamma was determined				J Med Chem 46: 5121-4 (2003) Article DOI: 10.1021/jm034173l BindingDB Entry DOI: 10.7270/Q2D50MB0
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50135779 (2-(4-{3-[4-(2-Hydroxy-ethyl)-1-(4-methyl-benzyl)-5...) Show SMILES Cc1ccc(Cn2nc(CCCc3ccc(OC(C)(C)C(O)=O)cc3)n(CCO)c2=O)cc1 Show InChI InChI=1S/C25H31N3O5/c1-18-7-9-20(10-8-18)17-28-24(32)27(15-16-29)22(26-28)6-4-5-19-11-13-21(14-12-19)33-25(2,3)23(30)31/h7-14,29H,4-6,15-17H2,1-3H3,(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	6.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional Aut£noma de M£xico Curated by ChEMBL					Assay Description Agonist activity at PPARgamma				Bioorg Med Chem 20: 3523-32 (2012) Article DOI: 10.1016/j.bmc.2012.04.005 BindingDB Entry DOI: 10.7270/Q2MP54B4
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50135779 (2-(4-{3-[4-(2-Hydroxy-ethyl)-1-(4-methyl-benzyl)-5...) Show SMILES Cc1ccc(Cn2nc(CCCc3ccc(OC(C)(C)C(O)=O)cc3)n(CCO)c2=O)cc1 Show InChI InChI=1S/C25H31N3O5/c1-18-7-9-20(10-8-18)17-28-24(32)27(15-16-29)22(26-28)6-4-5-19-11-13-21(14-12-19)33-25(2,3)23(30)31/h7-14,29H,4-6,15-17H2,1-3H3,(H,30,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	27.0	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional Aut£noma de M£xico Curated by ChEMBL					Assay Description Agonist activity at PPARalpha				Bioorg Med Chem 20: 3523-32 (2012) Article DOI: 10.1016/j.bmc.2012.04.005 BindingDB Entry DOI: 10.7270/Q2MP54B4
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50135779 (2-(4-{3-[4-(2-Hydroxy-ethyl)-1-(4-methyl-benzyl)-5...) Show SMILES Cc1ccc(Cn2nc(CCCc3ccc(OC(C)(C)C(O)=O)cc3)n(CCO)c2=O)cc1 Show InChI InChI=1S/C25H31N3O5/c1-18-7-9-20(10-8-18)17-28-24(32)27(15-16-29)22(26-28)6-4-5-19-11-13-21(14-12-19)33-25(2,3)23(30)31/h7-14,29H,4-6,15-17H2,1-3H3,(H,30,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional Aut£noma de M£xico Curated by ChEMBL					Assay Description Agonist activity at PPARdelta				Bioorg Med Chem 20: 3523-32 (2012) Article DOI: 10.1016/j.bmc.2012.04.005 BindingDB Entry DOI: 10.7270/Q2MP54B4
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50135779 (2-(4-{3-[4-(2-Hydroxy-ethyl)-1-(4-methyl-benzyl)-5...) Show SMILES Cc1ccc(Cn2nc(CCCc3ccc(OC(C)(C)C(O)=O)cc3)n(CCO)c2=O)cc1 Show InChI InChI=1S/C25H31N3O5/c1-18-7-9-20(10-8-18)17-28-24(32)27(15-16-29)22(26-28)6-4-5-19-11-13-21(14-12-19)33-25(2,3)23(30)31/h7-14,29H,4-6,15-17H2,1-3H3,(H,30,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Division of Eli Lilly & Company Curated by ChEMBL					Assay Description Inhibitory activity of compound against the binding of human Peroxisome proliferator activated receptor delta was determined				J Med Chem 46: 5121-4 (2003) Article DOI: 10.1021/jm034173l BindingDB Entry DOI: 10.7270/Q2D50MB0
					More data for this Ligand-Target Pair