BDBM631398 N-((R)-1-(2-methyl-3- (trifluoromethyl)phenyl)ethyl)- 4-(((S)-1-methylpyrrolidin-3- yl)amino)-6-oxo-1- (tetrahydro-2H-pyran-4-yl)- 1,6-dihydropyridine-3- carboxamide::US20230348424, Example 4

SMILES C[C@@H](NC(=O)c1cn(C2CCOCC2)c(=O)cc1N[C@H]1CCN(C)C1)c1cccc(c1C)C(F)(F)F

InChI Key InChIKey=BEOWMEGMXXMKMH-UHFFFAOYSA-N

Data  1 IC50  1 Kd

  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 = 631398   

LigandPNGBDBM631398(N-((R)-1-(2-methyl-3- (trifluoromethyl)phenyl)ethy...)
Affinity DataIC50: 45.9nMAssay Description:Inhibition of the SOS 1:KRAS interaction was measured using purified GST-tagged KRAS (res. 1-169, G12C, purified based on Hillig, et al., Proc Natl A...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/20/2023
Entry Details
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TargetSon of sevenless homolog 1 [564-1049]()
SchröDinger

US Patent
LigandPNGBDBM631398(N-((R)-1-(2-methyl-3- (trifluoromethyl)phenyl)ethy...)
Affinity DataKd:  16nMAssay Description:Binding to SOS1 was measured using a SPR assay with purified recombinant human SOS1 substrate (res. 564-1049 with N-terminal Avi tag; purified and bi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/20/2023
Entry Details
Go to US Patent