BDBM631387 : (R)-N-(I-(2-methyl-3-(trifluoromethyl)phenyl)ethyl)-4-((I-methylpiperidin- 4-yl)amino)-6-oxo-1-(tetrahydro-2H-pyran-4-yl)-1,6-dihydropyridine-3-carboxamide::US20230348424, Example 1

SMILES C[C@@H](NC(=O)c1cn(C2CCOCC2)c(=O)cc1NC1CCN(C)CC1)c1cccc(c1C)C(F)(F)F

InChI Key InChIKey=FIVGYKZOFDQULT-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 = 631387   

LigandPNGBDBM631387(: (R)-N-(I-(2-methyl-3-(trifluoromethyl)phenyl)eth...)
Affinity DataIC50: 27.4nMAssay 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
LigandPNGBDBM631387(: (R)-N-(I-(2-methyl-3-(trifluoromethyl)phenyl)eth...)
Affinity DataKd:  6nMAssay 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