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BDBM50194996 4-(3-chloro-4-fluorophenylthio)-6-(2-morpholinoethylamino)quinoline-3-carbonitrile::CHEMBL374785

SMILES: Fc1ccc(Sc2c(cnc3ccc(NCCN4CCOCC4)cc23)C#N)cc1Cl

InChI Key: InChIKey=XANONFHPKVXODH-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50194996   
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
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM50194996
PNG
(4-(3-chloro-4-fluorophenylthio)-6-(2-morpholinoeth...)
Show SMILES Fc1ccc(Sc2c(cnc3ccc(NCCN4CCOCC4)cc23)C#N)cc1Cl
Show InChI InChI=1S/C22H20ClFN4OS/c23-19-12-17(2-3-20(19)24)30-22-15(13-25)14-27-21-4-1-16(11-18(21)22)26-5-6-28-7-9-29-10-8-28/h1-4,11-12,14,26H,5-10H2
PDB

NCI pathway
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KEGG

UniProtKB/SwissProt

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



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of Tpl2 kinase by ELISA


Bioorg Med Chem Lett 16: 6067-72 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.102
BindingDB Entry DOI: 10.7270/Q2W958TR
More data for this
Ligand-Target Pair