BDBM718652 US20250042890, Example 47

SMILES C#CC1(Nc2nc(=O)n(-c3cccnc3)c3cc(C(F)(F)F)cc(OC)c23)CC1

InChI Key InChIKey=KOFROKZVHQWXMI-UHFFFAOYSA-N

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 718652   

TargetS-adenosylmethionine synthase isoform type-2(Human)
Insilico Medicine IP

US Patent
LigandPNGBDBM718652(US20250042890, Example 47)
Affinity DataIC50: 50nMAssay Description:Enzyme Reaction(1). Prepared 1×Assay buffer.(2). Preparation of compound concentration gradient: the compounds test condition were 1 uM start, 3-fold...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/12/2025
Entry Details
US Patent