BDBM551873 & 32 & 33: (3-amino-6-(methylsulfonyl)-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-2-yl)(6-ethyl-1,2,3,4-tetrahydroquinolin-4-yl)methanone::US11312723, Example 31

SMILES CCc1ccc2NCCC(C(=O)n3nc(N)c4CCN(Cc34)S(C)(=O)=O)c2c1

InChI Key InChIKey=LBSDTNGERQTEKR-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 551873   

TargetCoagulation factor XII(Human)
Rockefeller University

US Patent
LigandChemical structure of BindingDB Monomer ID 551873BDBM551873(& 32 & 33: (3-amino-6-(methylsulfonyl)-4,5,6,7-tet...)
Affinity DataIC50: 4.00E+4nMAssay Description:In a 96-well clear bottom plate, 80 μl of assay buffer was added to each well. Assay buffer consists of 0.5× Hank's Balanced Salt Solution (...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/6/2022
Entry Details
US Patent