BDBM476489 (2S)-N-[(3-chloro-1H-indol-5- yl)methyl]-4-(4,4-dimethyl-5-phenyl- 4,5-dihydro-1,3-oxazol-2-yl)-1- (N2,N2,N6,N6-tetramethyl-D- lysyl)piperazine-2-carboxamide::US10875851, Example 145::US10875851, Example 146

SMILES CN(C)CCCC[C@H](C(=O)N1CCN(C2=NC(C)(C)C(c3ccccc3)O2)C[C@H]1C(=O)NCc1ccc2[nH]cc(Cl)c2c1)N(C)C

InChI Key InChIKey=JUXWSYYCPWVGQG-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 = 476489   

TargetCoagulation factor XII(Human)
Merck Sharp & Dohme

US Patent
LigandChemical structure of BindingDB Monomer ID 476489BDBM476489((2S)-N-[(3-chloro-1H-indol-5- yl)methyl]-4-(4,4-di...)
Affinity DataIC50: 5.70nMAssay 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

TargetCoagulation factor XII(Human)
Merck Sharp & Dohme

US Patent
LigandChemical structure of BindingDB Monomer ID 476489BDBM476489((2S)-N-[(3-chloro-1H-indol-5- yl)methyl]-4-(4,4-di...)
Affinity DataIC50: 6.70nMAssay 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