BDBM50085510 Cyclic urea 2,4-diazepin-3-one analogue::bis(2,2,2-trifluoroacetate); [amino(3-{2-oxo-3-[1-(pyridin-3-ylmethyl)piperidin-4-yl]-1,3-diazepan-1-yl}phenyl)methylidene]azanium

SMILES NC(=[NH2+])c1cccc(c1)N1CCCCN(C2CCN(Cc3cccnc3)CC2)C1=O

InChI Key InChIKey=LXJUNRHFUFGQGD-UHFFFAOYSA-O

Data  2 KI

  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 = 50085510   

TargetCoagulation factor X(Homo sapiens (Human))
Dupont Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50085510(Cyclic urea 2,4-diazepin-3-one analogue | bis(2,2,...)
Affinity DataKi:  670nMAssay Description:Inhibition of coagulation factor XaMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetProthrombin(Homo sapiens (Human))
Dupont Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50085510(Cyclic urea 2,4-diazepin-3-one analogue | bis(2,2,...)
Affinity DataKi:  5.30E+3nMAssay Description:Inhibitory activity against thrombinMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed