BDBM549522 US11304929, Example 01-030::methyl 2-(4-{[(4-chloro-1,6-dimethyl-1H-indol-2- yl)formamido]methyl}benzenesulfonyl)acetate

SMILES COC(=O)CS(=O)(=O)c1ccc(CNC(=O)c2cc3c(Cl)cc(C)cc3n2C)cc1

InChI Key InChIKey=KPUHIUIDWCFOQD-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 549522   

TargetD-3-phosphoglycerate dehydrogenase(Human)
Boehringer Ingelheim International

US Patent
LigandPNGBDBM549522(methyl 2-(4-{[(4-chloro-1,6-dimethyl-1H-indol-2- y...)
Affinity DataIC50: 3.39E+3nMAssay Description:Compounds are dispensed onto assay plates (black, low volume, flat bottom 384 well, Corning) using an Access Labcyte Workstation with the Labcyte Ech...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/31/2022
Entry Details
US Patent