BDBM285896 7-(5-(5-carboxythiophen-2-yl)-1H-imidazol-2-yl)-3-(5-chloro-2-(1H-tetrazol-1-yl)phenyl)-7-hydroxy-6,7-dihydro-5H-cyclopenta[b]pyridine-1-oxide::US10081617, Example 44::US10081617, Example 45

SMILES CC(C)(C)OC(=O)Nc1ccc(Cl)cc1-c1cc2CCC(O)(C(=O)OCC(=O)c3ccc(s3)C(=O)OC(C)(C)C)c2[n+]([O-])c1

InChI Key InChIKey=ZNLOQKQSTLHDRT-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 285896   

TargetCoagulation factor XI(Human)
Merck Sharp & Dohme

US Patent
LigandPNGBDBM285896(7-(5-(5-carboxythiophen-2-yl)-1H-imidazol-2-yl)-3-...)
Affinity DataIC50: 1.22nMpH: 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
LigandPNGBDBM285896(7-(5-(5-carboxythiophen-2-yl)-1H-imidazol-2-yl)-3-...)
Affinity DataIC50: 57.5nMpH: 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