BDBM50109159 CHEMBL3600934

SMILES: O=C(NCc1ccccc1)c1ccc(NC(=O)c2cccc(CN3[C@H](Cc4ccccc4)COC3=O)c2)cc1

InChI Key: InChIKey=QXPGDMOHKPEQDS-GDLZYMKVSA-N

Data: 2 EC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50109159   

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))	BDBM50109159 (CHEMBL3600934) Show SMILES O=C(NCc1ccccc1)c1ccc(NC(=O)c2cccc(CN3[C@H](Cc4ccccc4)COC3=O)c2)cc1 |r| Show InChI InChI=1S/C32H29N3O4/c36-30(33-20-24-10-5-2-6-11-24)26-14-16-28(17-15-26)34-31(37)27-13-7-12-25(18-27)21-35-29(22-39-32(35)38)19-23-8-3-1-4-9-23/h1-18,29H,19-22H2,(H,33,36)(H,34,37)/t29-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	>1	n/a	n/a	n/a	n/a
IQM-CSIC Curated by ChEMBL					Assay Description Agonist activity at human PPARalpha transfected in human MCF7 cells after 16 hrs by luciferase reporter gene assay				J Med Chem 58: 6639-52 (2015) BindingDB Entry DOI: 10.7270/Q29025KV
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50109159 (CHEMBL3600934) Show SMILES O=C(NCc1ccccc1)c1ccc(NC(=O)c2cccc(CN3[C@H](Cc4ccccc4)COC3=O)c2)cc1 |r| Show InChI InChI=1S/C32H29N3O4/c36-30(33-20-24-10-5-2-6-11-24)26-14-16-28(17-15-26)34-31(37)27-13-7-12-25(18-27)21-35-29(22-39-32(35)38)19-23-8-3-1-4-9-23/h1-18,29H,19-22H2,(H,33,36)(H,34,37)/t29-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	>1	n/a	n/a	n/a	n/a
IQM-CSIC Curated by ChEMBL					Assay Description Agonist activity at human PPARgamma transfected in human MCF7 cells after 16 hrs by luciferase reporter gene assay				J Med Chem 58: 6639-52 (2015) BindingDB Entry DOI: 10.7270/Q29025KV
					More data for this Ligand-Target Pair