BDBM229809 US12522582, Example 128

SMILES NS(=O)(=O)c1cc2c(cc1F)C[C@@H](C(F)F)N2C(=O)[C@@H]1Cc2ccc(-c3ccccn3)cc2C1

InChI Key InChIKey=ATDAYSHEHZWJHM-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 229809   

TargetCarbonic anhydrase 2(Human)
Gilead Sciences

US Patent
LigandChemical structure of BindingDB Monomer ID 229809BDBM229809(US12522582, Example 128)
Affinity DataIC50: 7.42E+3nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/26/2026
Entry Details
US Patent

TargetCarbonic anhydrase 1(Human)
Gilead Sciences

US Patent
LigandChemical structure of BindingDB Monomer ID 229809BDBM229809(US12522582, Example 128)
Affinity DataIC50: 5.00E+4nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/26/2026
Entry Details
US Patent