BDBM50155324 CHEMBL3780894

SMILES: CCCC(Sc1nc2cc(Cl)ccc2s1)C(=O)NS(=O)(=O)c1ccc(cc1)[N+]([O-])=O

InChI Key: InChIKey=BEIQSAXXWHREFS-UHFFFAOYSA-N

Data: 1 IC50

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 1 hit for monomerid = 50155324   

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 (PPAR alpha) (Homo sapiens (Human))	BDBM50155324 (CHEMBL3780894) Show SMILES CCCC(Sc1nc2cc(Cl)ccc2s1)C(=O)NS(=O)(=O)c1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C18H16ClN3O5S3/c1-2-3-16(29-18-20-14-10-11(19)4-9-15(14)28-18)17(23)21-30(26,27)13-7-5-12(6-8-13)22(24)25/h4-10,16H,2-3H2,1H3,(H,21,23)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	850	n/a	n/a	n/a	n/a	n/a	n/a
Universit£"G. d'Annunzio" Curated by ChEMBL					Assay Description Antagonist activity at PPARalpha (unknown origin) expressed in HEK293A cells assessed as inhibition of GW7647-induced transactivation after 16 to 18 ...				Eur J Med Chem 114: 191-200 (2016) BindingDB Entry DOI: 10.7270/Q2H9972K
					More data for this Ligand-Target Pair