BDBM484752 1-(4-{6-[(3R)-3-amino-1,3-dihydrospiro[indene-2,4′-piperidin]-1′-yl]-1H-pyrazolo[3,4-b]pyrazin-3-yl}-1,2,3,4-tetrahydroquinoxalin-1-yl)ethan-1-one (RTX-1084025) and (1-(4-{6-[(3S)-3-amino-1,3-dihydrospiro[indene-2,4′-piperidin]-1′-yl]-1H-pyrazolo[3,4-b]pyrazin-3-yl}-1,2,3,4-tetrahydroquinoxalin-1-yl)ethan-1-one::US10934302, Example 1

SMILES CC(=O)N1CCN(c2n[nH]c3nc(cnc23)N2CCC3(Cc4ccccc4[C@@H]3N)CC2)c2ccccc12

InChI Key InChIKey=CNPYYVLNLFJBTD-UHFFFAOYSA-N

Data  1 IC50

  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 1 hit for monomerid = 484752   

TargetSH2B adapter protein 2(Human)
Relay Therapeutics

US Patent
LigandPNGBDBM484752(US10934302, Example 1 | 1-(4-{6-[(3R)-3-amino-1,3-...)
Affinity DataIC50: 50nMAssay Description:SHP2 is allosterically activated through binding of bis-tyrosyl-phorphorylated peptides to its Src Homology 2 (SH2) domains. The latter activation st...More data for this Ligand-Target Pair
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Date in BDB:
9/12/2021
Entry Details
US Patent