BDBM50428869 CHEMBL2331778

SMILES: CCNC(=O)c1cc(NS(=O)(=O)c2ccc(cc2)[N+]([O-])=O)ccc1Oc1cncc(Cl)c1

InChI Key: InChIKey=OJAPMQOSCNHZIR-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 = 50428869   

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))	BDBM50428869 (CHEMBL2331778) Show SMILES CCNC(=O)c1cc(NS(=O)(=O)c2ccc(cc2)[N+]([O-])=O)ccc1Oc1cncc(Cl)c1 Show InChI InChI=1S/C20H17ClN4O6S/c1-2-23-20(26)18-10-14(3-8-19(18)31-16-9-13(21)11-22-12-16)24-32(29,30)17-6-4-15(5-7-17)25(27)28/h3-12,24H,2H2,1H3,(H,23,26)	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	49	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Displacement of [3H]-rosiglitazone from GST-tagged PPARgammaLBD (unknown origin) after 1 hr by scintillation proximity assay				Bioorg Med Chem 21: 979-92 (2013) Article DOI: 10.1016/j.bmc.2012.11.058 BindingDB Entry DOI: 10.7270/Q23F4R13
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor (Homo sapiens (Human))	BDBM50428869 (CHEMBL2331778) Show SMILES CCNC(=O)c1cc(NS(=O)(=O)c2ccc(cc2)[N+]([O-])=O)ccc1Oc1cncc(Cl)c1 Show InChI InChI=1S/C20H17ClN4O6S/c1-2-23-20(26)18-10-14(3-8-19(18)31-16-9-13(21)11-22-12-16)24-32(29,30)17-6-4-15(5-7-17)25(27)28/h3-12,24H,2H2,1H3,(H,23,26)	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	n/a	n/a	400	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Transactivation of GAL4 DBD-fused human PPARgamma-LBD expressed in HEK293 cells after 24 hrs by luciferase reporter gene assay				Bioorg Med Chem 21: 979-92 (2013) Article DOI: 10.1016/j.bmc.2012.11.058 BindingDB Entry DOI: 10.7270/Q23F4R13
					More data for this Ligand-Target Pair