BDBM25226 2,4-Pyrimidine derivative, 28::4-N-(5-chloro-2H-1,3-benzodioxol-4-yl)-2-N-(3-methanesulfonylphenyl)pyrimidine-2,4-diamine

SMILES CS(=O)(=O)c1cccc(Nc2nccc(Nc3c4OCOc4ccc3Cl)n2)c1

InChI Key InChIKey=QTFCKBFCXDAZIU-UHFFFAOYSA-N

Data  6 IC50

PDB links: 1 PDB ID matches 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 6 hits for monomerid = 25226   

TargetEphrin type-B receptor 4(Homo sapiens (Human))
Astrazeneca

LigandPNGBDBM25226(2,4-Pyrimidine derivative, 28 | 4-N-(5-chloro-2H-1...)
Affinity DataIC50:  90nMpH: 7.4 T: 2°CAssay Description:This assay detects inhibitors of EphB4-mediated phosphorylation of a polypeptide substrate using Alphascreen luminescence detection technology. The r...More data for this Ligand-Target Pair
TargetEphrin type-B receptor 4(Homo sapiens (Human))
Astrazeneca

LigandPNGBDBM25226(2,4-Pyrimidine derivative, 28 | 4-N-(5-chloro-2H-1...)
Affinity DataIC50:  90nMAssay Description:Inhibition of EphB4More data for this Ligand-Target Pair
TargetCytochrome P450 3A4(Homo sapiens (Human))
Astrazeneca

Curated by ChEMBL
LigandPNGBDBM25226(2,4-Pyrimidine derivative, 28 | 4-N-(5-chloro-2H-1...)
Affinity DataIC50:  2.60E+3nMAssay Description:Inhibition of CYP3A4 in human liver microsomes by fluorometric assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetEphrin type-B receptor 4(Homo sapiens (Human))
Astrazeneca

LigandPNGBDBM25226(2,4-Pyrimidine derivative, 28 | 4-N-(5-chloro-2H-1...)
Affinity DataIC50:  25nMAssay Description:Inhibition of EphB4 by acoustic dispensing assayMore data for this Ligand-Target Pair
TargetEphrin type-B receptor 4(Homo sapiens (Human))
Astrazeneca

LigandPNGBDBM25226(2,4-Pyrimidine derivative, 28 | 4-N-(5-chloro-2H-1...)
Affinity DataIC50:  187nMAssay Description:Inhibition of EphB4 autophosphorylation expressed in CHOK1 cellsMore data for this Ligand-Target Pair
TargetEphrin type-B receptor 4(Homo sapiens (Human))
Astrazeneca

LigandPNGBDBM25226(2,4-Pyrimidine derivative, 28 | 4-N-(5-chloro-2H-1...)
Affinity DataIC50:  190nMAssay Description:Inhibition of Myc-His-tagged EphB4 expressed in CHOK1 cells assessed as phosphorylation by ELISAMore data for this Ligand-Target Pair