BDBM653335 2-amino-7-fluoro-4- (3,7,7-trimethyl-2-(2-(2- propenoyl)-2,6- diazaspiro[3.4]octan-6- yl)-7,8-dihydro-5H- pyrano[4,3-b]pyridin-4- yl)-1-benzothiophene-3- carbonitrile::US20240059703, Example 14-106

SMILES Cc1c(nc2CC(C)(C)OCc2c1-c1ccc(F)c2sc(N)c(C#N)c12)N1CCC2(CN(C2)C(=O)C=C)C1

InChI Key InChIKey=OLXUUWFTNRLRCC-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 = 653335   

LigandPNGBDBM653335(US20240059703, Example 14-106 | 2-amino-7-fluoro-4...)
Affinity DataIC50: 46nMAssay Description:Purified GDP-bound KRAS protein (aa 1-169), containing both G12C and C118A amino acid substitutions and an N-terminal His-tag, was pre-incubated in a...More data for this Ligand-Target Pair
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Date in BDB:
4/24/2024
Entry Details
US Patent