BDBM582091 US11518761, Example 172

SMILES N#Cc1cccc(Cc2nn([C@H]3C[C@H](F)C3)c3ncnc(N)c23)c1

InChI Key InChIKey=SXDBGXWADZZVNZ-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 = 582091   

TargetCalmodulin-domain protein kinase 1(Toxoplasma gondii)
Vyera Pharmaceuticals

US Patent
LigandChemical structure of BindingDB Monomer ID 582091BDBM582091(US11518761, Example 172)
Affinity DataIC50: 45.9nMAssay Description:Certain of the compounds prepared as described above were assayed to determine their IC50 for inhibition of T. gondii CDPK1 (tgCDPK1). At least three...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/5/2023
Entry Details
US Patent