BDBM653305 (M)-1-(6-((1R,9R)-5- fluoro-6-(3-hydroxy-1- naphthalenyl)-10,10- dimethyl-3- azatricyclo[7.1.1.02,7] undeca-2,4,6-trien-4-yl)-2,6- diazaspiro[3.4]octan-2- yl)-2-propen-1-one (1st eluting isomer)::US20240059703, Example 14-76::US20240059703, Example 14-77

SMILES CC1(C)[C@@H]2C[C@H]1c1nc(N3CCC4(CN(C4)C(=O)C=C)C3)c(F)c(c1C2)-c1cc(O)cc2ccccc12

InChI Key InChIKey=OODLIPAMTKJYFP-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 653305   

LigandPNGBDBM653305(US20240059703, Example 14-76 | US20240059703, Exam...)
Affinity DataIC50: 3.95E+3nMAssay 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
In Depth
Date in BDB:
4/24/2024
Entry Details
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LigandPNGBDBM653305(US20240059703, Example 14-76 | US20240059703, Exam...)
Affinity DataIC50: 13nMAssay 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
In Depth
Date in BDB:
4/24/2024
Entry Details
Go to US Patent