BDBM604256 US11661419, Example 5::US20230280220, Example 5

SMILES CC(C1CCOCC1)C(=O)N(C)c1cc2nc([nH]c2cc1C)-c1n[nH]c2C[C@@]3(C)C[C@H]3Cc12

InChI Key InChIKey=VMHXSNSRTJMIPH-QGAXJPMMSA-N

Data  2 IC50

  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 2 hits for monomerid = 604256   

TargetTyrosine-protein kinase ITK/TSK(Homo sapiens (Human))
Pfizer

US Patent
LigandPNGBDBM604256(US11661419, Example 5 | US20230280220, Example 5)
Affinity DataIC50:  5nMAssay Description:1.0M HEPES Buffer pH 7.5 solution was prepared as follows: 238.3 g HEPES free acid (Sigma) and 800 mL of water were combined, and the mixture was sti...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent
TargetTyrosine-protein kinase ITK/TSK(Homo sapiens (Human))
Pfizer

US Patent
LigandPNGBDBM604256(US11661419, Example 5 | US20230280220, Example 5)
Affinity DataIC50:  5nMAssay Description:ITK activity was determined by measuring the effect of a test compound in an ITK enzyme assay. 1.0 M HEPES Buffer pH 7.5 solution was prepared as fol...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent