BDBM50406429 CHEMBL5276842

SMILES N[C@@H]1c2ccccc2CC11CCN(CC1)c1nc2nc(Sc3cccnc3C(F)(F)F)cnc2[nH]1

InChI Key InChIKey=REEKVEYVOMDHAS-UHFFFAOYSA-N

Data  2 IC50  1 Kd  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 4 hits for monomerid = 50406429   

LigandPNGBDBM50406429(CHEMBL5276842)
Affinity DataKd:  0.600nMAssay Description:Binding affinity to N-terminal biotinylated AviTag-G4SG4S-tagged recombinant SHP2 (1 to 525 residues) (unknown origin) by SPR analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/18/2024
Entry Details
PubMed
LigandPNGBDBM50406429(CHEMBL5276842)
Affinity DataIC50: 5nMAssay 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
LigandPNGBDBM50406429(CHEMBL5276842)
Affinity DataEC50:  42nMAssay 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
LigandPNGBDBM50406429(CHEMBL5276842)
Affinity DataIC50: 1.80E+3nMAssay Description:Displacement of E-4031 from hERG by fluorescence polarization assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/18/2024
Entry Details
PubMed