BDBM81734 PPY-A

SMILES COc1ccccc1-c1c[nH]c2ncc(cc12)-c1cncc(c1)C(=O)N(C)C

InChI Key InChIKey=GYQRHHQPEMOLKH-UHFFFAOYSA-N

Data  1 KI  2 IC50

PDB links: 2 PDB IDs match this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 81734   

TargetTyrosine-protein kinase ABL1(Human)
Boston University

Curated by ChEMBL
LigandPNGBDBM81734(PPY-A)
Affinity DataKi:  20nMAssay Description:Inhibition of ABL1 (unknown origin)More data for this Ligand-Target Pair
TargetTyrosine-protein kinase ABL1(Human)
Boston University

Curated by ChEMBL
LigandPNGBDBM81734(PPY-A)
Affinity DataIC50:  20nMpH: 7.4 T: 25°CAssay Description:Inhibition of wild-type Abl and Abl T315I kinase activity was measured in a homogeneous time-resolved fluorescence resonance energy transfer (TR-FRET...More data for this Ligand-Target Pair
TargetTyrosine-protein kinase ABL1 [T315I](Human)
Ariad Pharmaceuticals

LigandPNGBDBM81734(PPY-A)
Affinity DataIC50:  9nMpH: 7.4 T: 25°CAssay Description:Inhibition of wild-type Abl and Abl T315I kinase activity was measured in a homogeneous time-resolved fluorescence resonance energy transfer (TR-FRET...More data for this Ligand-Target Pair