BDBM50058812 CHEMBL302625::N,N'-1,3-Propanediylbis(3,4,5-trihydroxybenzamide)Hydrate::US9120744, CDE-070

SMILES Oc1cc(cc(O)c1O)C(=O)NCCCNC(=O)c1cc(O)c(O)c(O)c1

InChI Key InChIKey=LLUICHYMAUMIIP-UHFFFAOYSA-N

Data  1 KI  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 2 hits for monomerid = 50058812   

TargetCatechol O-methyltransferase(Sus scrofa)
University Of Otago

Curated by ChEMBL
LigandPNGBDBM50058812(CHEMBL302625 | N,N'-1,3-Propanediylbis(3,4,5-trihy...)
Affinity DataKi:  6.60E+3nMAssay Description:In vitro inhibitory activity against Catechol-O-methyltransferase from porcine liver; Uncompetitive mode of inhibitionMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetPlasminogen activator inhibitor 1(Homo sapiens (Human))
University Of Michigan

US Patent
LigandPNGBDBM50058812(CHEMBL302625 | N,N'-1,3-Propanediylbis(3,4,5-trihy...)
Affinity DataIC50:  2.69E+5nMpH: 7.8 T: 2°CAssay Description:To determine the efficacy of various synthesized PAI-1 inhibitor compounds, a fluorometric plate assay was carried out to measure the half maximal in...More data for this Ligand-Target Pair
In DepthDetails US Patent