BDBM498919 N-{(3S,4R)-1-(N~2~- cyclohexyl- N~2~,N~6~,N~6~- trimethyl-D-lysyl)-3- [(thiophen-2- ylmethyl)carbamoyl]pi- peridin-4-yl}-3,4- dihydroquinoline- 1(2H)-carboxamide::US11014920, Compound 27

SMILES CN(C)CCCC[C@@H](N(C)C1CCCCC1)C(=O)N1CC[C@@H](NC(=O)N2CCCc3ccccc23)[C@H](C1)C(=O)NCc1cccs1

InChI Key InChIKey=RBGGCLKRMPIDMY-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 = 498919   

TargetCoagulation factor XII(Human)
Merck Sharp & Dohme

US Patent
LigandPNGBDBM498919(N-{(3S,4R)-1-(N~2~- cyclohexyl- N~2~,N~6~,N~6~- tr...)
Affinity DataIC50: 110nMAssay Description:Factor XIIa activity determinations were made in 50 mM HEPES buffer containing 150 mM NaCl, 5 mM CaCl2, and 0.1% PEG 8000 (polyethylene glycol; JT Ba...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/22/2021
Entry Details
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