BDBM631496 : N-((R)-1-(3-(difluoromethyl)-2-fluorophenyl)ethyl)-1-((3S,4R)-3- fluorotetrahydro-2H-pyran-4-yl)-4-((1-methylpiperidin-4-yl)amino)-6-oxo-1,6-dihydropyridine- 3-carboxamide::US20230348424, Example 79

SMILES C[C@@H](NC(=O)c1cn([C@@H]2CCOC[C@H]2F)c(=O)cc1NC1CCN(C)CC1)c1cccc(C(F)F)c1F

InChI Key InChIKey=LECCRWPQHHHXEG-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 = 631496   

LigandPNGBDBM631496(US20230348424, Example 79 | : N-((R)-1-(3-(difluor...)
Affinity DataIC50: 3.70nMAssay 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
LigandPNGBDBM631496(US20230348424, Example 79 | : N-((R)-1-(3-(difluor...)
Affinity DataKd:  2nMAssay 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