BDBM87268 2-(4-methylsulfonyl-2-nitro-phenyl)sulfanyl-1,3-benzothiazole::2-(4-methylsulfonyl-2-nitrophenyl)sulfanyl-1,3-benzothiazole::2-[(4-mesyl-2-nitro-phenyl)thio]-1,3-benzothiazole::2-[(4-methylsulfonyl-2-nitrophenyl)thio]-1,3-benzothiazole::2-{[4-(methylsulfonyl)-2-nitrophenyl]thio}-1,3-benzothiazole::MLS000573281::SMR000194783::cid_1580704

SMILES CC1(NS(=O)(=O)c2ccc3c4c(C5CCN(C(=O)N6CC[C@@H](O)C6)CC5)ncnc4n(-c4nnc(C(F)F)s4)c3c2)CC1

InChI Key InChIKey=DJWWULBFFOLLNM-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 87268   

TargetPoly(ADP-ribose) glycohydrolase(Human)
Danatlas Pharmaceuticals

US Patent
LigandChemical structure of BindingDB Monomer ID 87268BDBM87268(US20250388589, Example 132)
Affinity DataIC50: 0.000100nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute (TSRI) Assay...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/6/2026
Entry Details
US Patent