BDBM684778 US20240228491, Example 55

SMILES Nc1c(-c2ccc3nnccc3c2)c(=O)n(-c2ccc(Cl)cc2)c2nc(ccc12)C(F)(F)F

InChI Key InChIKey=BCWQZUGTBNODRB-UHFFFAOYSA-N

Data  1 IC50

  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 = 684778   

TargetS-adenosylmethionine synthase isoform type-2(Human)
Scinnohub Pharmaceutical

US Patent
LigandPNGBDBM684778(US20240228491, Example 55)
Affinity DataIC50: 16.3nMAssay Description:The specific steps were as follows: The compounds having the test starling concentration of 1 uM or 10 uM were diluted into 10 concentration points i...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/22/2024
Entry Details
US Patent