BDBM285981 US10081617, Example 128::US10081617, Example 129::methyl [4-(4-chloro-2-{3- [5-chloro-2-(1H-tetrazol-1- yl)phenyl]-1-oxido-5,6,7,8- tetrahydroquinolin-8-yl}- 1H-imidazol-5- yl)phenyl]carbamate

SMILES COC(=O)Nc1ccc(cc1)-c1[nH]c(nc1Cl)C1CCCc2cc(c[n+]([O-])c12)-c1cc(Cl)ccc1-n1cnnn1

InChI Key InChIKey=FGPLSPWRWGTBCT-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 = 285981   

TargetCoagulation factor XI(Human)
Merck Sharp & Dohme

US Patent
LigandPNGBDBM285981(methyl [4-(4-chloro-2-{3- [5-chloro-2-(1H-tetrazol...)
Affinity DataIC50: 198nMpH: 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
Go to US Patent

TargetCoagulation factor XI(Human)
Merck Sharp & Dohme

US Patent
LigandPNGBDBM285981(methyl [4-(4-chloro-2-{3- [5-chloro-2-(1H-tetrazol...)
Affinity DataIC50: 0.640nMpH: 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
Go to US Patent