BDBM450977 US10676470, Compound 15::US11332464, Compound 3

SMILES NCCCCC(NC(=O)[C@H]1CCCN(C1)C(=O)CCc1ccccc1)C(=O)c1nc2ccccc2s1

InChI Key InChIKey=LZIQKKGKSQRLJR-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 450977   

TargetLys-gingipain W83(Porphyromonas gingivalis)
Cortexyme

US Patent
LigandPNGBDBM450977(US10676470, Compound 15 | US11332464, Compound 3)
Affinity DataIC50: 5.5nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain were measured in a fluorogenic assay similar to thos...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/11/2021
Entry Details
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TargetLys-gingipain(Porphyromonas gingivalis)
Cortexyme

US Patent
LigandPNGBDBM450977(US10676470, Compound 15 | US11332464, Compound 3)
Affinity DataIC50: 17.5nMAssay Description:Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions. Protein: 0.1 nM Kgp, isolated from culture of...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/21/2022
Entry Details
Go to US Patent