BDBM771413 US12415799, Compound 4

SMILES FCCCN1CC(Nc2ncc(C3=C(CC(F)(F)F)CCCc4c3ccc3[nH]ncc43)cn2)C1

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 = 771413   

TargetCytochrome P450 3A4(Human)
Zhejiang Yangli Pharmaceutical Technology Co.

US Patent
LigandPNGBDBM771413(US12415799, Compound 4)
Affinity DataIC50: 1.11E+4nMAssay Description:Experimental operation: Firstly, the test compound (10 mM) was subjected to gradient dilution to prepare a working solution (100×final concentration)...More data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
12/29/2025
Entry Details
US Patent

TargetCytochrome P450 1A2(Human)
Zhejiang Yangli Pharmaceutical Technology Co.

US Patent
LigandPNGBDBM771413(US12415799, Compound 4)
Affinity DataIC50: 5.00E+4nMAssay Description:Experimental operation: Firstly, the test compound (10 mM) was subjected to gradient dilution to prepare a working solution (100×final concentration)...More data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
12/29/2025
Entry Details
US Patent