BDBM476435 2-chlorophenyl (3S)-4-{N2-[4- (aminomethyl)cyclohexyl]-N6,N6- dimethyl-D-lysyl}-3-[(thiophen-2- ylmethyl)carbamoyl]piperazine-1- carboxylate::US10875851, Example 91

SMILES CN(C)CCCC[C@@H](NC1CCC(CN)CC1)C(=O)N1CCN(C(=O)Oc2ccccc2Cl)C[C@H]1C(=O)NCc1cccs1

InChI Key InChIKey=IYHLYHPQEPSOMD-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 = 476435   

TargetCoagulation factor XII(Human)
Merck Sharp & Dohme

US Patent
LigandChemical structure of BindingDB Monomer ID 476435BDBM476435(2-chlorophenyl (3S)-4-{N2-[4- (aminomethyl)cyclohe...)
Affinity DataIC50: 12.3nMAssay 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