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BDBM50194987 4-(3-chloro-4-fluorophenylamino)-6-(thiazol-2-ylmethylamino)quinoline-3-carbonitrile::CHEMBL221269

SMILES: Fc1ccc(Nc2c(cnc3ccc(NCc4nccs4)cc23)C#N)cc1Cl

InChI Key: InChIKey=MQDSUQQVRVQHSX-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50194987   
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))
BDBM50194987
PNG
(4-(3-chloro-4-fluorophenylamino)-6-(thiazol-2-ylme...)
Show SMILES Fc1ccc(Nc2c(cnc3ccc(NCc4nccs4)cc23)C#N)cc1Cl
Show InChI InChI=1S/C20H13ClFN5S/c21-16-8-14(1-3-17(16)22)27-20-12(9-23)10-26-18-4-2-13(7-15(18)20)25-11-19-24-5-6-28-19/h1-8,10,25H,11H2,(H,26,27)
PDB

NCI pathway
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KEGG

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 31n/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