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BDBM50062662 2-Cyclohexylamino-4-trifluoromethyl-pyrimidine-5-carboxylic acid (3,5-dichloro-phenyl)-amide::CHEMBL134876

SMILES: FC(F)(F)c1nc(NC2CCCCC2)ncc1C(=O)Nc1cc(Cl)cc(Cl)c1

InChI Key: InChIKey=UJEMQSTUVYRJHK-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 = 50062662   
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
Nuclear factor NF-kappa-B (NF-kB)


(Homo sapiens (Human))
BDBM50062662
PNG
(2-Cyclohexylamino-4-trifluoromethyl-pyrimidine-5-c...)
Show SMILES FC(F)(F)c1nc(NC2CCCCC2)ncc1C(=O)Nc1cc(Cl)cc(Cl)c1
Show InChI InChI=1S/C18H17Cl2F3N4O/c19-10-6-11(20)8-13(7-10)25-16(28)14-9-24-17(27-15(14)18(21,22)23)26-12-4-2-1-3-5-12/h6-9,12H,1-5H2,(H,25,28)(H,24,26,27)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Signal Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against human Jurkat T-Cells stably transfected with an Nuclear factor kappa B transcription factor


J Med Chem 41: 413-9 (1998)

More data for this
Ligand-Target Pair
Activating transcription factor 1


(Homo sapiens)
BDBM50062662
PNG
(2-Cyclohexylamino-4-trifluoromethyl-pyrimidine-5-c...)
Show SMILES FC(F)(F)c1nc(NC2CCCCC2)ncc1C(=O)Nc1cc(Cl)cc(Cl)c1
Show InChI InChI=1S/C18H17Cl2F3N4O/c19-10-6-11(20)8-13(7-10)25-16(28)14-9-24-17(27-15(14)18(21,22)23)26-12-4-2-1-3-5-12/h6-9,12H,1-5H2,(H,25,28)(H,24,26,27)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Signal Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against human Jurkat T-Cells stably transfected with activating transcription factor 1


J Med Chem 41: 413-9 (1998)

More data for this
Ligand-Target Pair