BDBM604821 7-[(5R,7R,8R,12aR,14R,15R,15aS,16R)-14-(6- amino-9H-purin-9-yl)-10,15,16-trihydroxy- 2,10-dioxido-2-sulfanyloctahydro-12H-5,8- methanofuro[3,2-l] [1,3,6,9,11,2,10]pentaoxadiphosphacyclotetradecin- 7-yl]-5-fluoro-3-methyl-3,7-dihydro-4H- pyrrolo[2,3-d]pyrimidin-4-one di-triethylamine salt::US11666594, Example 23 (optical isomer 1)

SMILES Cn1cnc2n(cc(F)c2c1=O)[C@@H]1O[C@@H]2CO[P@@](S)(=O)O[C@@H]3[C@@H](COP(O)(=O)O[C@@H]1[C@@H]2O)O[C@H]([C@@H]3O)n1cnc2c(N)ncnc12

InChI Key InChIKey=NHDDLAVIFNYQSN-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 = 604821   

TargetStimulator of interferon genes protein(Human)
Takeda Pharmaceutical

US Patent
LigandPNGBDBM604821(7-[(5R,7R,8R,12aR,14R,15R,15aS,16R)-14-(6- amino-9...)
Affinity DataIC50: 170nMAssay Description:The above-mentioned biotinylated STING protein (wild-type (WT)) was prepared by the following method. The culture solution was centrifuged, the obtai...More data for this Ligand-Target Pair
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Date in BDB:
7/9/2023
Entry Details
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