BDBM498904 N-[(3S,4R)-3-{[4-(amino- methyl)benzyl]carbamoyl}- 1-(N-cyclohexyl-3- cyclopropyl-D- alanyl)piperidin-4-yl]- 6-azaspiro[2.5]octane- 6-carboxamide::US11014920, Compound 12

SMILES NCc1ccc(CNC(=O)[C@H]2CN(CC[C@H]2NC(=O)N2CCC3(CC3)CC2)C(=O)[C@@H](CC2CC2)NC2CCCCC2)cc1

InChI Key InChIKey=JBOFOKYBEJQHDU-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 498904   

TargetCoagulation factor XII(Human)
Merck Sharp & Dohme

US Patent
LigandPNGBDBM498904(N-[(3S,4R)-3-{[4-(amino- methyl)benzyl]carbamoyl}-...)
Affinity DataIC50: 41.7nMAssay Description:Factor XIIa activity determinations were made in 50 mM HEPES buffer 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:
11/22/2021
Entry Details
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