BDBM50015234 4,4''[1,6-HEXANEDIYLBIS(OXY)]BISBENZENECARBOXIMIDAMIDE::4-[6-(4-Carbamimidoyl-phenoxy)-hexyloxy]-benzamidine::4-{6-[4-amino(imino)methylphenoxy]hexyloxy}phenyl-iminomethanamine::4-{6-[4-ammino(imino)methylphenoxy]hexyloxy}phenyl-iminomethanammine::CHEMBL25105::Hexamidine::US9138393, Hexamidine diisethionate::US9144538, Hexamidine diisethionate

SMILES NC(=N)c1ccc(OCCCCCCOc2ccc(cc2)C(N)=N)cc1

InChI Key InChIKey=OQLKNTOKMBVBKV-UHFFFAOYSA-N

Data  4 KI  3 IC50

PDB links: 1 PDB ID matches this monomer.

  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 7 hits for monomerid = 50015234   

TargetProthrombin(Homo sapiens (Human))
Georgetown University Medical Center

Curated by ChEMBL
LigandPNGBDBM50015234(4,4''[1,6-HEXANEDIYLBIS(OXY)]BISBENZENECARBOXIMIDA...)
Affinity DataKi:  224nMAssay Description:compound was tested for inhibitory activity against ThrombinMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSuppressor of tumorigenicity 14 protein(Homo sapiens (Human))
Georgetown University Medical Center

Curated by ChEMBL
LigandPNGBDBM50015234(4,4''[1,6-HEXANEDIYLBIS(OXY)]BISBENZENECARBOXIMIDA...)
Affinity DataKi:  924nMAssay Description:compound was tested for inhibitory activity against MatriptaseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSerine protease 1(Homo sapiens (Human))
University of North Carolina

Curated by ChEMBL
LigandPNGBDBM50015234(4,4''[1,6-HEXANEDIYLBIS(OXY)]BISBENZENECARBOXIMIDA...)
Affinity DataKi:  2.70E+3nMAssay Description:Inhibition of trypsin by amidase assay.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetUrokinase-type plasminogen activator(Homo sapiens (Human))
Georgetown University Medical Center

Curated by ChEMBL
LigandPNGBDBM50015234(4,4''[1,6-HEXANEDIYLBIS(OXY)]BISBENZENECARBOXIMIDA...)
Affinity DataKi:  1.44E+4nMAssay Description:compound was tested for inhibitory activity against Urokinase-type plasminogen activator(microPa)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 3A4(Homo sapiens (Human))
The Procter & Gamble

US Patent
LigandPNGBDBM50015234(4,4''[1,6-HEXANEDIYLBIS(OXY)]BISBENZENECARBOXIMIDA...)
Affinity DataIC50: >1.00E+4nMAssay Description:Cytochrome P450 is a large and diverse group of enzymes that catalyze the oxidation of organic substances. Some members of the CYP family contribute ...More data for this Ligand-Target Pair
In DepthDetails US Patent
TargetCytochrome P450 3A4(Homo sapiens (Human))
The Procter & Gamble

US Patent
LigandPNGBDBM50015234(4,4''[1,6-HEXANEDIYLBIS(OXY)]BISBENZENECARBOXIMIDA...)
Affinity DataIC50: >1.00E+4nMAssay Description:A commercially available P450-GLO Assay kit (Promega Corporation, Madison Wis.) is used to screen various compounds for CYP3A4A inhibition activity. ...More data for this Ligand-Target Pair
In DepthDetails US Patent
TargetProtein arginine N-methyltransferase 1(Homo sapiens)
Csir-Indian Institute Of Chemical Biology

Curated by ChEMBL
LigandPNGBDBM50015234(4,4''[1,6-HEXANEDIYLBIS(OXY)]BISBENZENECARBOXIMIDA...)
Affinity DataIC50:  5.20E+4nMAssay Description:Inhibition of PRMT1 (unknown origin)More data for this Ligand-Target Pair
In DepthDetails PubMed