BDBM185656 US9161922, Table 3, Compound 1

SMILES NCC#CCC(N)C(=O)NCCc1ccccc1

InChI Key InChIKey=NRUPVSGBQHKOBB-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 185656   

TargetMembrane primary amine oxidase(Bos taurus (Bovine))
Case Western Reserve University

US Patent
LigandPNGBDBM185656(US9161922, Table 3, Compound 1)
Affinity DataIC50:  1.80E+6nMpH: 7.2 T: 2°CAssay Description:In the following Examples, 0.9 mL aliquots of a solution of candidate inhibitor in 100 mM potassium phosphate buffer, pH 7.2 was mixed bovine plasma ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent
TargetAmine oxidase(Komagataella pastoris (Yeast) (Pichia pastoris))
Case Western Reserve University

US Patent
LigandPNGBDBM185656(US9161922, Table 3, Compound 1)
Affinity DataIC50:  2.50E+5nMpH: 7.2 T: 2°CAssay Description:In the following Examples, 0.9 mL aliquots of a solution of candidate inhibitor in 100 mM potassium phosphate buffer, pH 7.2 was mixed bovine plasma ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent
TargetHistamine oxidase(Arthrobacter globiformis)
Case Western Reserve University

US Patent
LigandPNGBDBM185656(US9161922, Table 3, Compound 1)
Affinity DataIC50:  2.50E+5nMpH: 7.2 T: 2°CAssay Description:In the following Examples, 0.9 mL aliquots of a solution of candidate inhibitor in 100 mM potassium phosphate buffer, pH 7.2 was mixed bovine plasma ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent