BDBM524728 US11168093, Example 49b

SMILES C[C@@H]1NCCC=C1c1cc2c(Nc3cc4ncsc4cc3F)ccnc2s1

InChI Key InChIKey=MDDYHQIKHYRKTM-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 = 524728   

LigandPNGBDBM524728(US11168093, Example 49b)
Affinity DataIC50: 10nMAssay Description:All data was collected using a standard TR-FRET screening assay: LanthaScreen Tracer 199 at 50 nM, Eu-anti-His Antibody at 2 nM, 5 nM RIPK2 enzyme, a...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/27/2022
Entry Details
US Patent