BDBM631489 1-((1S,2R)-[1,1′-bi(cyclopropan)]-2-yl)-N-((R)-1-(3- (difluoromethyl)-2-fluorophenyl)ethyl)-4-(((1R5S,6s)-3-methyl-3-azabicyclo[3.1.0]hexan-6- yl)amino)-6-oxo-1,6-dihydropyridine-3-carboxamide (Example 71)::US20230348424, Example 72

SMILES C[C@@H](NC(=O)c1cn([C@H]2C[C@@H]2C2CC2)c(=O)cc1N[C@@H]1[C@H]2CN(C)C[C@@H]12)c1cccc(C(F)F)c1F

InChI Key InChIKey=QDHCSNMFEDWAKH-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 = 631489   

LigandPNGBDBM631489(US20230348424, Example 72 | 1-((1S,2R)-[1,1′...)
Affinity DataIC50: 9.70nMAssay 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
LigandPNGBDBM631489(US20230348424, Example 72 | 1-((1S,2R)-[1,1′...)
Affinity DataKd:  3nMAssay 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