BDBM67086 US20250361240, Compound Example 4

SMILES [2H][C@@]1(NC(=O)CC)CCOc2c(-c3cc4c(cc3F)N(C)C(=O)CC4)cncc21

InChI Key InChIKey=FADFAGHPTDGHCK-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 = 67086   

TargetCytochrome P450 11B2, mitochondrial(Human)
Zhejiang Yangli Pharmaceutical Technology Co.

US Patent
LigandChemical structure of BindingDB Monomer ID 67086BDBM67086(US20250361240, Compound Example 4)
Affinity DataIC50: 42.7nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/8/2026
Entry Details Article
PubMed
TargetCytochrome P450 11B1, mitochondrial(Human)
Zhejiang Yangli Pharmaceutical Technology Co.

US Patent
LigandChemical structure of BindingDB Monomer ID 67086BDBM67086(US20250361240, Compound Example 4)
Affinity DataIC50: 4.80E+3nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/8/2026
Entry Details Article
PubMed