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BDBM50013741 CHEMBL3264931

SMILES: CCn1c(CCCc2ccc(cc2)-c2ccc(NS(=O)(=O)c3ccccc3)cc2)nn(Cc2ccc(cc2)C(C)(C)C)c1=O

InChI Key: InChIKey=FCIVGWFSXSZTNG-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50013741   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50013741
PNG
(CHEMBL3264931)
Show SMILES CCn1c(CCCc2ccc(cc2)-c2ccc(NS(=O)(=O)c3ccccc3)cc2)nn(Cc2ccc(cc2)C(C)(C)C)c1=O
Show InChI InChI=1S/C36H40N4O3S/c1-5-39-34(37-40(35(39)41)26-28-16-22-31(23-17-28)36(2,3)4)13-9-10-27-14-18-29(19-15-27)30-20-24-32(25-21-30)38-44(42,43)33-11-7-6-8-12-33/h6-8,11-12,14-25,38H,5,9-10,13,26H2,1-4H3
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 21n/an/an/an/an/an/a



Inception Sciences

Curated by ChEMBL


Assay Description
Antagonist activity at human PPAR-alpha assessed as inhibition of GW7647-induced effect after overnight incubation by cell-based luciferase reporter ...


Bioorg Med Chem Lett 24: 2267-72 (2014)


Article DOI: 10.1016/j.bmcl.2014.03.090
BindingDB Entry DOI: 10.7270/Q2GX4D33
More data for this
Ligand-Target Pair