BDBM50293670 CHEMBL560158::N-(4-(4-(1H-pyrazol-3-ylamino)quinazolin-2-ylthio)phenyl)acetamide

SMILES CC(=O)Nc1ccc(Sc2nc(Nc3ccn[nH]3)c3ccccc3n2)cc1

InChI Key InChIKey=WHSOGGOFMJGWDM-UHFFFAOYSA-N

Data  4 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50293670   

TargetAurora kinase A(Human)
Vertex Pharmaceuticals

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50293670BDBM50293670(N-(4-(4-(1H-pyrazol-3-ylamino)quinazolin-2-ylthio)...)
Affinity DataKi:  24nMAssay Description:Inhibition of Aurora-A by coupled assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/26/2010
Entry Details Article
PubMed
TargetProto-oncogene tyrosine-protein kinase Src(Human)
Vertex Pharmaceuticals

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50293670BDBM50293670(N-(4-(4-(1H-pyrazol-3-ylamino)quinazolin-2-ylthio)...)
Affinity DataKi:  277nMAssay Description:Inhibition of SrcMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/26/2010
Entry Details Article
PubMed
TargetGlycogen synthase kinase-3 beta(Human)
Vertex Pharmaceuticals

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50293670BDBM50293670(N-(4-(4-(1H-pyrazol-3-ylamino)quinazolin-2-ylthio)...)
Affinity DataKi:  605nMAssay Description:Inhibition of GSK3-betaMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/26/2010
Entry Details Article
PubMed
TargetAurora kinase B(Human)
Vertex Pharmaceuticals

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50293670BDBM50293670(N-(4-(4-(1H-pyrazol-3-ylamino)quinazolin-2-ylthio)...)
Affinity DataKi: >1.10E+3nMAssay Description:Inhibition of Aurora-BMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/26/2010
Entry Details Article
PubMed