BDBM653279 1-(6-((1R,9R)-5-fluoro- 6-(5-hydroxy-2- methylphenyl)-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::US20240059703, Example 14-50::US20240059703, Example 14-59::US20240059703, Example 14-60

SMILES C=CC(=O)N1CC2(CCN(c3nc4c(c(-c5cc(O)ccc5C)c3F)C[C@H]3C[C@@H]4C3(C)C)C2)C1

InChI Key InChIKey=ARVPIFCKVDXHAZ-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 653279   

LigandChemical structure of BindingDB Monomer ID 653279BDBM653279(US20240059703, Example 14-50 | US20240059703, Exam...)
Affinity DataIC50: 25nMAssay 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
US Patent

LigandChemical structure of BindingDB Monomer ID 653279BDBM653279(US20240059703, Example 14-50 | US20240059703, Exam...)
Affinity DataIC50: 65nMAssay 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
US Patent

LigandChemical structure of BindingDB Monomer ID 653279BDBM653279(US20240059703, Example 14-50 | US20240059703, Exam...)
Affinity DataIC50: 3.35E+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
US Patent