BindingDB logo
myBDB logout

BDBM50134238 CHEMBL3740002

SMILES: FC(F)(F)c1ccc(nc1)S(=O)(=O)CCNC(=O)c1cnc2ccccc2c1

InChI Key: InChIKey=DWICMVYFMPAZJL-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50134238   
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 delta


(Homo sapiens (Human))
BDBM50134238
PNG
(CHEMBL3740002)
Show SMILES FC(F)(F)c1ccc(nc1)S(=O)(=O)CCNC(=O)c1cnc2ccccc2c1
Show InChI InChI=1S/C18H14F3N3O3S/c19-18(20,21)14-5-6-16(24-11-14)28(26,27)8-7-22-17(25)13-9-12-3-1-2-4-15(12)23-10-13/h1-6,9-11H,7-8H2,(H,22,25)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

PubMed
n/an/a 1.43E+3n/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Binding affinity to GST-PPAR-beta/delta LBP (unknown origin) after 3 hrs by TR-FRET assay


Bioorg Med Chem 24: 247-60 (2016)


BindingDB Entry DOI: 10.7270/Q2Z89F70
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50134238
PNG
(CHEMBL3740002)
Show SMILES FC(F)(F)c1ccc(nc1)S(=O)(=O)CCNC(=O)c1cnc2ccccc2c1
Show InChI InChI=1S/C18H14F3N3O3S/c19-18(20,21)14-5-6-16(24-11-14)28(26,27)8-7-22-17(25)13-9-12-3-1-2-4-15(12)23-10-13/h1-6,9-11H,7-8H2,(H,22,25)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

PubMed
n/an/a 2.32E+3n/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Binding affinity to GST-PPAR-beta/delta LBP (unknown origin) after 24 hrs by TR-FRET assay


Bioorg Med Chem 24: 247-60 (2016)


BindingDB Entry DOI: 10.7270/Q2Z89F70
More data for this
Ligand-Target Pair