BDBM652918 (P)-1-(6-(3,7,7- trimethyl-4-(5- methyl-1H- indazol-4-yl)- 5,6,7,8- tetrahydro-2- quinolinyl)-2,6- diazaspiro[3.4] octan-2-yl)-2- propen-1-one (2nd eluting peak)::US20240059703, Example 2-11::US20240059703, Example 2-12::US20240059703, Example 2-28

SMILES C=CC(=O)N1CC2(CCN(c3nc4c(c(-c5c(C)ccc6[nH]ncc56)c3C)CCC(C)(C)C4)C2)C1

InChI Key InChIKey=AENYBOOFAHBIET-UHFFFAOYSA-N

Data  3 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 3 hits for monomerid = 652918   

LigandChemical structure of BindingDB Monomer ID 652918BDBM652918(US20240059703, Example 2-12 | (P)-1-(6-(3,7,7- tri...)
Affinity DataIC50: 27nMAssay 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 652918BDBM652918(US20240059703, Example 2-12 | (P)-1-(6-(3,7,7- tri...)
Affinity DataIC50: 67nMAssay 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 652918BDBM652918(US20240059703, Example 2-12 | (P)-1-(6-(3,7,7- tri...)
Affinity DataIC50: 1.11E+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