BDBM285959 US10081617, Example 106::US10081617, Example 107::methyl [3-chloro-4-(2-{3-[3- chloro-2-fluoro-6-(1H-tetrazol- 1-yl)phenyl]-7-hydroxy-1- oxido-6,7-dihydro-5H- cyclopenta[b]pyridin-7-yl}-1H- imidazol-5-yl)phenyl]carbamate

SMILES COC(=O)Nc1ccc(-c2cnc(C3(O)CCc4cc(-c5c(-n6cnnn6)ccc(Cl)c5F)c[n+]([O-])c43)[nH]2)c(Cl)c1

InChI Key InChIKey=MFRXNVNGDXDSRL-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 = 285959   

TargetCoagulation factor XI(Human)
Merck Sharp & Dohme

US Patent
LigandChemical structure of BindingDB Monomer ID 285959BDBM285959(methyl [3-chloro-4-(2-{3-[3- chloro-2-fluoro-6-(1H...)
Affinity DataIC50: 0.340nMpH: 7.4Assay Description:Factor XIa determinations were made in 50 mM HEPES buffer at pH 7.4 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:
1/12/2019
Entry Details
US Patent

TargetCoagulation factor XI(Human)
Merck Sharp & Dohme

US Patent
LigandChemical structure of BindingDB Monomer ID 285959BDBM285959(methyl [3-chloro-4-(2-{3-[3- chloro-2-fluoro-6-(1H...)
Affinity DataIC50: 45.7nMpH: 7.4Assay Description:Factor XIa determinations were made in 50 mM HEPES buffer at pH 7.4 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:
1/12/2019
Entry Details
US Patent