BDBM542727 4-(3-((8-fluoro-2-(4-(trifluoromethyl)phenyl)-2,3- dihydrobenzo[b][1,4]dioxin-6-yl)methyl)-3H-imidazo[4,5- b]pyridin-6-yl)-2-methylbut-3-yn-2-amine::4-(3-((8-fluoro-2-(4-(trifluoromethyl)phenyl)-2,3-dihydrobenzo[b][1,4]dioxin-6-yl)methyl)-3H-imidazo[4,5-b]pyridin-6-yl)-2-methylbut-3-yn-2-amine::US11274108, Example 1-29

SMILES CC(C)(N)C#Cc1cnc2n(Cc3cc(F)c4OC(COc4c3)c3ccc(cc3)C(F)(F)F)cnc2c1

InChI Key InChIKey=YKBGWGADWDWYHI-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 = 542727   

LigandPNGBDBM542727(US11274108, Example 1-29 | 4-(3-((8-fluoro-2-(4-(t...)
Affinity DataIC50: 7nMAssay Description:All assay reaction conditions for IC50 determinations were within the linear range with respect to time and enzyme concentration. In a 384 well polyp...More data for this Ligand-Target Pair
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Date in BDB:
7/5/2022
Entry Details
US Patent