Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 384.4 BDBM50148441

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 3 hits in this display   

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))	BDBM50148441 (2-{4-[2-(1,2,3,4-Tetrahydro-quinolin-7-yloxy)-etho...) Show SMILES NC(=O)C(Cc1ccc(OCCOc2ccc3CCCNc3c2)cc1)C(O)=O Show InChI InChI=1S/C21H24N2O5/c22-20(24)18(21(25)26)12-14-3-6-16(7-4-14)27-10-11-28-17-8-5-15-2-1-9-23-19(15)13-17/h3-8,13,18,23H,1-2,9-12H2,(H2,22,24)(H,25,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	140	n/a	n/a	n/a	n/a
Research Institute of Tsinghua University Curated by ChEMBL					Assay Description In vitro transcription activation on human peroxisome proliferator activated receptor-alpha (PPAR alpha)				Bioorg Med Chem Lett 14: 3507-11 (2004) Article DOI: 10.1016/j.bmcl.2004.04.053 BindingDB Entry DOI: 10.7270/Q2RF5TG1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50148441 (2-{4-[2-(1,2,3,4-Tetrahydro-quinolin-7-yloxy)-etho...) Show SMILES NC(=O)C(Cc1ccc(OCCOc2ccc3CCCNc3c2)cc1)C(O)=O Show InChI InChI=1S/C21H24N2O5/c22-20(24)18(21(25)26)12-14-3-6-16(7-4-14)27-10-11-28-17-8-5-15-2-1-9-23-19(15)13-17/h3-8,13,18,23H,1-2,9-12H2,(H2,22,24)(H,25,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	3.62E+3	n/a	n/a	n/a	n/a
Research Institute of Tsinghua University Curated by ChEMBL					Assay Description In vitro transcription activation on human peroxisome proliferator activated receptor-delta (PPAR delta)				Bioorg Med Chem Lett 14: 3507-11 (2004) Article DOI: 10.1016/j.bmcl.2004.04.053 BindingDB Entry DOI: 10.7270/Q2RF5TG1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50148441 (2-{4-[2-(1,2,3,4-Tetrahydro-quinolin-7-yloxy)-etho...) Show SMILES NC(=O)C(Cc1ccc(OCCOc2ccc3CCCNc3c2)cc1)C(O)=O Show InChI InChI=1S/C21H24N2O5/c22-20(24)18(21(25)26)12-14-3-6-16(7-4-14)27-10-11-28-17-8-5-15-2-1-9-23-19(15)13-17/h3-8,13,18,23H,1-2,9-12H2,(H2,22,24)(H,25,26)	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	2.88E+3	n/a	n/a	n/a	n/a
Research Institute of Tsinghua University Curated by ChEMBL					Assay Description In vitro transcription activation on human peroxisome proliferator activated receptor-gamma (PPAR gamma)				Bioorg Med Chem Lett 14: 3507-11 (2004) Article DOI: 10.1016/j.bmcl.2004.04.053 BindingDB Entry DOI: 10.7270/Q2RF5TG1
					More data for this Ligand-Target Pair