BDBM50465532 CHEMBL4286347

SMILES: COc1cc(ccc1Cc1cn(C)c2ccc(NC(=O)NC3CCCCC3)cc12)C(=O)NS(=O)(=O)c1cc(Cl)cc(Cl)c1

InChI Key: InChIKey=UAZVAVXMYLMNGU-UHFFFAOYSA-N

Data: 1 IC50  1 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 = 50465532   

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 (Homo sapiens (Human))	BDBM50465532 (CHEMBL4286347) Show SMILES COc1cc(ccc1Cc1cn(C)c2ccc(NC(=O)NC3CCCCC3)cc12)C(=O)NS(=O)(=O)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C31H32Cl2N4O5S/c1-37-18-21(27-17-25(10-11-28(27)37)35-31(39)34-24-6-4-3-5-7-24)12-19-8-9-20(13-29(19)42-2)30(38)36-43(40,41)26-15-22(32)14-23(33)16-26/h8-11,13-18,24H,3-7,12H2,1-2H3,(H,36,38)(H2,34,35,39)	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	740	n/a	n/a	n/a	n/a
Goethe University Frankfurt Curated by ChEMBL					Assay Description Partial agonist activity at human PPARgamma LBD expressed HEK293T cells after 12 to 14 hrs by dual-glo luciferase reporter gene assay				J Med Chem 61: 5758-5764 (2018) Article DOI: 10.1021/acs.jmedchem.8b00458 BindingDB Entry DOI: 10.7270/Q2TX3J21
					More data for this Ligand-Target Pair
EBifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50465532 (CHEMBL4286347) Show SMILES COc1cc(ccc1Cc1cn(C)c2ccc(NC(=O)NC3CCCCC3)cc12)C(=O)NS(=O)(=O)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C31H32Cl2N4O5S/c1-37-18-21(27-17-25(10-11-28(27)37)35-31(39)34-24-6-4-3-5-7-24)12-19-8-9-20(13-29(19)42-2)30(38)36-43(40,41)26-15-22(32)14-23(33)16-26/h8-11,13-18,24H,3-7,12H2,1-2H3,(H,36,38)(H2,34,35,39)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	550	n/a	n/a	n/a	n/a	n/a	n/a
Goethe University Frankfurt Curated by ChEMBL					Assay Description Inhibition of recombinant human sEH using PHOME as substrate preincubated for 30 mins followed by substrate addition and measured after 30 mins by sp...				J Med Chem 61: 5758-5764 (2018) Article DOI: 10.1021/acs.jmedchem.8b00458 BindingDB Entry DOI: 10.7270/Q2TX3J21
					More data for this Ligand-Target Pair