BDBM50406428 CHEMBL5289545

SMILES C[C@@H]1OCC2(CCN(CC2)c2nc3nc(Sc4cccnc4C(F)(F)F)cnc3[nH]2)[C@@H]1N

InChI Key InChIKey=CAENYNHIAMXYPJ-UHFFFAOYSA-N

Data  1 IC50  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50406428   

LigandPNGBDBM50406428(CHEMBL5289545)
Affinity DataIC50: 64nMAssay Description:Allosteric inhibition of IRS1 peptide-activated human recombinant SHP2 (Met1 to Leu525) expressed in Escherichia coli assessed as inhibition of depho...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/18/2024
Entry Details
PubMed
LigandPNGBDBM50406428(CHEMBL5289545)
Affinity DataEC50:  2.85E+3nMAssay Description:Allosteric inhibition of SHP2 in human KYSE-520 cells assessed as inhibition of ERK phosphorylation incubated for 2 hrs by TR-FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/18/2024
Entry Details
PubMed