BDBM719044 N-(2-(1H-indol-3-yl)ethyl)-2-(5-fluoropyridin-3-yl)-6-(methylsulfonyl)-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-4-amine::US12221439, Example 25

SMILES CS(=O)(=O)N1Cc2nc(-c3cncc(F)c3)nc(NCCc3c[nH]c4ccccc34)c2C1

InChI Key InChIKey=GTJHHXKCDYKHEZ-UHFFFAOYSA-N

Data  1 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 = 719044   

TargetCytochrome P450 1A1(Human)
Jaguahr Therapeutics

US Patent
LigandPNGBDBM719044(N-(2-(1H-indol-3-yl)ethyl)-2-(5-fluoropyridin-3-yl...)
Affinity DataIC50: 631nMAssay Description:The direct CYP1A1 inhibitory activity of test compounds was also assessed using the Promega P450-Glo assay system. Seven concentrations of test compo...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/15/2025
Entry Details
Go to US Patent