BDBM631490 1-((1R,2S)-[1,1′-bi(cyclopropan)]-2-yl)-N-((R)-1-(3- (difluoromethyl)-2-fluorophenyl)ethyl)-4-((1-methylpiperidin-4-yl)amino)-6-oxo-1,6- dihydropyridine-3-carboxamide::US20230348424, Example 73::US20230348424, Example 74

SMILES C[C@@H](NC(=O)c1cn([C@H]2C[C@@H]2C2CC2)c(=O)cc1NC1CCN(C)CC1)c1cccc(C(F)F)c1F

InChI Key InChIKey=UCLXDXULUSMDJL-UHFFFAOYSA-N

Data  2 IC50  1 Kd

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 631490   

TargetSon of sevenless homolog 1 [564-1049](Human)
SchröDinger

US Patent
LigandPNGBDBM631490(US20230348424, Example 73 | 1-((1R,2S)-[1,1′...)
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
US Patent

LigandPNGBDBM631490(US20230348424, Example 73 | 1-((1R,2S)-[1,1′...)
Affinity DataIC50: 4.60nMAssay 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
US Patent

LigandPNGBDBM631490(US20230348424, Example 73 | 1-((1R,2S)-[1,1′...)
Affinity DataIC50: 13nMAssay 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
US Patent