BDBM476443 (2S)-1-(N2-cyclohexyl-N6,N6- dimethyl-D-lysyl)-4- (cyclopentylacetyl)-N-(thiophen-2- ylmethyl)piperazine-2-carboxamide::US10875851, Example 99

SMILES CN(C)CCCC[C@@H](NC1CCCCC1)C(=O)N1CCN(C[C@H]1C(=O)NCc1cccs1)C(=O)CC1CCCC1

InChI Key InChIKey=FALKQHSVQTXMCG-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 476443   

TargetCoagulation factor XII(Human)
Merck Sharp & Dohme

US Patent
LigandChemical structure of BindingDB Monomer ID 476443BDBM476443((2S)-1-(N2-cyclohexyl-N6,N6- dimethyl-D-lysyl)-4- ...)
Affinity DataIC50: 29.7nMAssay 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