BDBM226504 US9328096, 197

SMILES C[C@H]1C[C@@H](NC(=O)C2(c3ccc(Cl)cc3O)CC2)CN(c2nnn[nH]2)C1

InChI Key InChIKey=XMGCFDGCDVWYDE-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 226504   

LigandChemical structure of BindingDB Monomer ID 226504BDBM226504(1-(4-chloro-2-hydroxyphenyl)-N-((3R,5S)- 5-methyl-...)
Affinity DataIC50: 48nMAssay 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:
5/20/2026
Entry Details
US Patent

LigandChemical structure of BindingDB Monomer ID 226504BDBM226504(1-(4-chloro-2-hydroxyphenyl)-N-((3R,5S)- 5-methyl-...)
Affinity DataIC50: 1.00E+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:
5/20/2026
Entry Details
US Patent