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BDBM50195014 6-(3-aminobenzylamino)-4-(3-chloro-4-fluorophenylamino)quinoline-3-carbonitrile::CHEMBL222954

SMILES: Nc1cccc(CNc2ccc3ncc(C#N)c(Nc4ccc(F)c(Cl)c4)c3c2)c1

InChI Key: InChIKey=JYHWHJFSRNAZIQ-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50195014   
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))
BDBM50195014
PNG
(6-(3-aminobenzylamino)-4-(3-chloro-4-fluorophenyla...)
Show SMILES Nc1cccc(CNc2ccc3ncc(C#N)c(Nc4ccc(F)c(Cl)c4)c3c2)c1
Show InChI InChI=1S/C23H17ClFN5/c24-20-10-18(4-6-21(20)25)30-23-15(11-26)13-29-22-7-5-17(9-19(22)23)28-12-14-2-1-3-16(27)8-14/h1-10,13,28H,12,27H2,(H,29,30)
PDB

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UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 140n/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