BDBM476512 (2S)-4-[(4S,5S)-5-(3-bromophenyl)-4- methyl-4,5-dihydro-1,3-oxazol-2-yl]- N-(3-chlorobenzyl)-1-[N-(1- methylethyl)-6-piperidin-1-yl-D- norleucyl]piperazine-2-carboxamide::US10875851, Example 168

SMILES CC(C)N[C@H](CCCCN1CCCCC1)C(=O)N1CCN(C2=N[C@@H](C)[C@H](c3cccc(Br)c3)O2)C[C@H]1C(=O)NCc1cccc(Cl)c1

InChI Key InChIKey=NVAOKSCZZPSUDX-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 = 476512   

TargetCoagulation factor XII(Human)
Merck Sharp & Dohme

US Patent
LigandChemical structure of BindingDB Monomer ID 476512BDBM476512((2S)-4-[(4S,5S)-5-(3-bromophenyl)-4- methyl-4,5-di...)
Affinity DataIC50: 8.20nMAssay Description:The effectiveness of a compound of the present invention as an inhibitor of Coagulation Factor XIIa can be determined using a relevant purified serin...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/25/2021
Entry Details
US Patent