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BDBM50092874 2,4-Bis-trifluoromethyl-pyrimidine-5-carboxylic acid (3,5-bis-trifluoromethyl-phenyl)-amide::CHEMBL128314

SMILES: FC(F)(F)c1cc(NC(=O)c2cnc(nc2C(F)(F)F)C(F)(F)F)cc(c1)C(F)(F)F

InChI Key: InChIKey=FCHOECXTDICNPB-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50092874   
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
Transcription factor AP-1


(Homo sapiens (Human))
BDBM50092874
PNG
(2,4-Bis-trifluoromethyl-pyrimidine-5-carboxylic ac...)
Show SMILES FC(F)(F)c1cc(NC(=O)c2cnc(nc2C(F)(F)F)C(F)(F)F)cc(c1)C(F)(F)F
Show InChI InChI=1S/C15H5F12N3O/c16-12(17,18)5-1-6(13(19,20)21)3-7(2-5)29-10(31)8-4-28-11(15(25,26)27)30-9(8)14(22,23)24/h1-4H,(H,29,31)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



University of Texas Medical Branch

Curated by ChEMBL


Assay Description
Inhibition of AP-1-mediated transcriptional activation in human Jurkat cells by luciferase reporter gene assay


J Med Chem 57: 6930-48 (2014)


Article DOI: 10.1021/jm5004733
BindingDB Entry DOI: 10.7270/Q2222WDT
More data for this
Ligand-Target Pair
Transcription factor AP-1


(Homo sapiens (Human))
BDBM50092874
PNG
(2,4-Bis-trifluoromethyl-pyrimidine-5-carboxylic ac...)
Show SMILES FC(F)(F)c1cc(NC(=O)c2cnc(nc2C(F)(F)F)C(F)(F)F)cc(c1)C(F)(F)F
Show InChI InChI=1S/C15H5F12N3O/c16-12(17,18)5-1-6(13(19,20)21)3-7(2-5)29-10(31)8-4-28-11(15(25,26)27)30-9(8)14(22,23)24/h1-4H,(H,29,31)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Signal Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Concentration required to inhibit activator protein-1(AP-1) mediated transcriptional activation in human Jurkat T-cells


J Med Chem 43: 3995-4004 (2000)


BindingDB Entry DOI: 10.7270/Q26M363N
More data for this
Ligand-Target Pair