BDBM775046 US20250304578, Compound Cpd-1

SMILES COC1N=C(C(=O)NS(C)(=O)=O)C=CC1NCC#Cc1cc2c(N[C@@H]3CCN(C)C[C@@H]3F)cccn2c1CC(F)(F)F

InChI Key

  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 = 775046   

TargetCytochrome P450 3A4/3A5(Human)
Nutshell Therapeutics (Shanghai) Co.

US Patent
LigandPNGBDBM775046(US20250304578, Compound Cpd-1)
Affinity DataIC50: 5.00E+4nMAssay Description:Liver microsomes were thawed in a 37° C. water bath prior to use. Liver microsome working solution (final system concentration of 0.5 mg/mL) was prep...More data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
1/19/2026
Entry Details
US Patent

TargetCytochrome P450 3A4/3A5(Human)
Nutshell Therapeutics (Shanghai) Co.

US Patent
LigandPNGBDBM775046(US20250304578, Compound Cpd-1)
Affinity DataIC50: 5.00E+4nMAssay Description:Liver microsomes were thawed in a 37° C. water bath prior to use. Liver microsome working solution (final system concentration of 0.5 mg/mL) was prep...More data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
1/19/2026
Entry Details
US Patent