BDBM551877 & 36: (3-amino-6-(methylsulfonyl)-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridine-2-yl)(8-methyl-1,2,3,4-tetrahydroquinolin-4-yl)methanone::US11312723, Example 35

SMILES Cc1cccc2[C@H](CCNc12)C(=O)n1nc2CN(CCc2c1N)S(C)(=O)=O

InChI Key InChIKey=HTCSUCDYUISMCG-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 551877   

TargetCoagulation factor XII(Human)
Rockefeller University

US Patent
LigandPNGBDBM551877(& 36: (3-amino-6-(methylsulfonyl)-4,5,6,7-tetrahyd...)
Affinity DataIC50: 20nMAssay 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
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TargetProthrombin(Human)
Rockefeller University

US Patent
LigandPNGBDBM551877(& 36: (3-amino-6-(methylsulfonyl)-4,5,6,7-tetrahyd...)
Affinity DataIC50: 1.80E+4nMAssay Description:Thrombin. In a 96-well white opaque plate, 80 μl of assay buffer was added to each well. Test compounds were added, and serially diluted as abov...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/6/2022
Entry Details
Go to US Patent