BDBM50328195 7-(4-methoxybenzyl)-N-(4-(trifluoromethoxy)phenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine::CHEMBL1257899::US9670214, TABLE 12.6

SMILES COc1ccc(Cn2ccc3c(Nc4ccc(OC(F)(F)F)cc4)ncnc23)cc1

InChI Key InChIKey=QSOAMPBHXPSPJY-UHFFFAOYSA-N

Data  2 IC50  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50328195   

TargetBreakpoint cluster region protein/Tyrosine-protein kinase ABL1(Human)
Harvard Medical School

Curated by ChEMBL
LigandPNGBDBM50328195(7-(4-methoxybenzyl)-N-(4-(trifluoromethoxy)phenyl)...)
Affinity DataEC50:  9.68E+3nMAssay Description:Inhibition of Bcr-Abl in mouse BA/F3 cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/12/2011
Entry Details Article
PubMed
TargetNon-specific protein-tyrosine kinase(Human)
Dana-Farber Cancer Institute

US Patent
LigandPNGBDBM50328195(7-(4-methoxybenzyl)-N-(4-(trifluoromethoxy)phenyl)...)
Affinity DataIC50: 9.68E+3nMpH: 7.5Assay Description:In vitro kinase assays were carried out by using recombinant murine c-abl containing SH3, SH2 and kinase domains (residues 46-531) and full length im...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/7/2018
Entry Details
Go to US Patent

TargetNon-specific protein-tyrosine kinase [T818I](Human)
Dana-Farber Cancer Institute

US Patent
LigandPNGBDBM50328195(7-(4-methoxybenzyl)-N-(4-(trifluoromethoxy)phenyl)...)
Affinity DataIC50: 1.00E+4nMpH: 7.5Assay Description:In vitro kinase assays were carried out by using recombinant murine c-abl containing SH3, SH2 and kinase domains (residues 46-531) and full length im...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/7/2018
Entry Details
Go to US Patent