BDBM698868 2-(1-(2-((1- ((dimethylamino)methyl)cyclopropyl) methoxy)-6-(3-hydroxy-8-iodo-1- naphthoyl)-6,7-dihydro-5H-pyrrolo [3,4-d]pyrimidin-4-yl)-3- hydroxypiperidin-3- yl)acetonitrile::US20240317759, Example 78

SMILES CN(C)CC1(COc2nc3CN(Cc3c(n2)N2CCCC(O)(CC#N)C2)C(=O)c2cc(O)cc3cccc(I)c23)CC1

InChI Key InChIKey=WEVIFVJHTGULSZ-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 = 698868   

TargetGTPase KRas [G12D]/Son of sevenless homolog 1 [564-1049](Human)
Taiho Pharmaceutical

US Patent
LigandPNGBDBM698868(2-(1-(2-((1- ((dimethylamino)methyl)cyclopropyl) m...)
Affinity DataIC50: 1.20E+3nMAssay Description:Recombinant KRAS G12C (amino acids 1-169, SEQ ID NO:1), KRAS G12D (amino acids 1-169, SEQ ID NO:2), KRAS G12V (amino acids 1-169, SEQ ID NO:3) and SO...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/28/2025
Entry Details
US Patent

TargetGTPase KRas [G12V]/Son of sevenless homolog 1 [564-1049](Human)
Taiho Pharmaceutical

US Patent
LigandPNGBDBM698868(2-(1-(2-((1- ((dimethylamino)methyl)cyclopropyl) m...)
Affinity DataIC50: 2.20E+3nMAssay Description:Recombinant KRAS G12C (amino acids 1-169, SEQ ID NO:1), KRAS G12D (amino acids 1-169, SEQ ID NO:2), KRAS G12V (amino acids 1-169, SEQ ID NO:3) and SO...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/28/2025
Entry Details
US Patent

TargetSon of sevenless homolog 1 [564-1049]/GTPase KRas [G12C](Human)
Taiho Pharmaceutical

US Patent
LigandPNGBDBM698868(2-(1-(2-((1- ((dimethylamino)methyl)cyclopropyl) m...)
Affinity DataIC50: 3.20E+3nMAssay Description:Recombinant KRAS G12C (amino acids 1-169, SEQ ID NO:1), KRAS G12D (amino acids 1-169, SEQ ID NO:2), KRAS G12V (amino acids 1-169, SEQ ID NO:3) and SO...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/28/2025
Entry Details
US Patent