Compile Data Set for Download or QSAR
Report error Found 72 Enz. Inhib. hit(s) with all data for entry = 50039058
TargetBotulinum neurotoxin type A(Clostridium botulinum)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM23274(BMCL176463 Compound 2 | BMC173072 Compound 2 | (2E...)
Affinity DataIC50: 410nMAssay Description:Inhibition of Clostridium botulinum toxin BoNT/A light chainMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetBotulinum neurotoxin type A(Clostridium botulinum)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308030(CHEMBL599255 | cid_2977478 | 5-chloro-7-((4-ethoxy...)
Affinity DataIC50: 500nMAssay Description:Inhibition of Clostridium botulinum toxin BoNT/A light chainMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetBotulinum neurotoxin type A(Clostridium botulinum)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308035(N'-(2-(Dimethylamino)ethyl)-2-(4-(4-(N'-2-(dimethy...)
Affinity DataIC50: 2.50E+3nMAssay Description:Inhibition of Clostridium botulinum toxin BoNT/A light chain by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetBotulinum neurotoxin type A(Clostridium botulinum)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308035(N'-(2-(Dimethylamino)ethyl)-2-(4-(4-(N'-2-(dimethy...)
Affinity DataIC50: 4.40E+3nMAssay Description:Inhibition of Clostridium botulinum toxin BoNT/A light chain by HPLC-based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetBotulinum neurotoxin type A(Clostridium botulinum)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308033(2-(4-(4-(6-(4,5-Dihydro-1H-imidazol-2-yl)benzo[b]t...)
Affinity DataIC50: 7.10E+3nMAssay Description:Inhibition of Clostridium botulinum toxin BoNT/A light chain by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetBotulinum neurotoxin type A(Clostridium botulinum)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308058(2-(4-(4-(6-(5-Hydroxy-1,4,5,6-tetrahydropyrimidin-...)
Affinity DataIC50: 7.30E+3nMAssay Description:Inhibition of Clostridium botulinum toxin BoNT/A light chain by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetBotulinum neurotoxin type A(Clostridium botulinum)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308040(6-(4,5-Dihydro-1H-imidazol-2-yl)-2-{4-[4-(4,5-dihy...)
Affinity DataIC50: 9.40E+3nMAssay Description:Inhibition of Clostridium botulinum toxin BoNT/A light chain by HPLC-based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetBotulinum neurotoxin type A(Clostridium botulinum)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50100895(2-(4-(4-carbamimidoylphenoxy)phenyl)-1H-indole-6-c...)
Affinity DataIC50: 1.10E+4nMAssay Description:Inhibition of Clostridium botulinum toxin BoNT/A light chain by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetBotulinum neurotoxin type A(Clostridium botulinum)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308040(6-(4,5-Dihydro-1H-imidazol-2-yl)-2-{4-[4-(4,5-dihy...)
Affinity DataIC50: 1.25E+4nMAssay Description:Inhibition of Clostridium botulinum toxin BoNT/A light chain by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetBotulinum neurotoxin type A(Clostridium botulinum)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50100895(2-(4-(4-carbamimidoylphenoxy)phenyl)-1H-indole-6-c...)
Affinity DataIC50: 1.70E+4nMAssay Description:Inhibition of Clostridium botulinum toxin BoNT/A light chain by HPLC-based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetLethal factor(Bacillus anthracis)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308033(2-(4-(4-(6-(4,5-Dihydro-1H-imidazol-2-yl)benzo[b]t...)
Affinity DataIC50: 1.80E+4nMAssay Description:Inhibition of Bacillus anthracis anthrax lethal factor by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetBotulinum neurotoxin type A(Clostridium botulinum)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50378658(CHEMBL164837)
Affinity DataIC50: 2.00E+4nMAssay Description:Inhibition of Clostridium botulinum toxin BoNT/A light chain by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetBotulinum neurotoxin type A(Clostridium botulinum)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308039(6-(1,4,5,6-Tetrahydropyrimidin-2-yl)-2-(4-(4-(1,4,...)
Affinity DataIC50: 2.10E+4nMAssay Description:Inhibition of Clostridium botulinum toxin BoNT/A light chain by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetBotulinum neurotoxin type A(Clostridium botulinum)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308059(6-(4,5-Dihydro-1H-imidazol-2-yl)-2-(4-(4-(4,5-dihy...)
Affinity DataIC50: 2.45E+4nMAssay Description:Inhibition of Clostridium botulinum toxin BoNT/A light chain by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetBotulinum neurotoxin type A(Clostridium botulinum)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308032(2-(4-(2,4-Dichlorophenoxy)phenyl)-6-(4,5-dihydro-1...)
Affinity DataIC50: 2.50E+4nMAssay Description:Inhibition of Clostridium botulinum toxin BoNT/A light chain by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetBotulinum neurotoxin type A(Clostridium botulinum)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308033(2-(4-(4-(6-(4,5-Dihydro-1H-imidazol-2-yl)benzo[b]t...)
Affinity DataIC50: 2.50E+4nMAssay Description:Inhibition of Clostridium botulinum toxin BoNT/A light chain by HPLC-based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetBotulinum neurotoxin type A(Clostridium botulinum)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308057(2-(4-(4-Cyanophenoxy)phenyl)-1H-indole-6-carboximi...)
Affinity DataIC50: 2.50E+4nMAssay Description:Inhibition of Clostridium botulinum toxin BoNT/A light chain by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetBotulinum neurotoxin type A(Clostridium botulinum)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308034(6-(1,4,5,6-Tetrahydropyrimidin-2-yl)-2-(4-(4-(1,4,...)
Affinity DataIC50: 2.80E+4nMAssay Description:Inhibition of Clostridium botulinum toxin BoNT/A light chain by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetLethal factor(Bacillus anthracis)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308035(N'-(2-(Dimethylamino)ethyl)-2-(4-(4-(N'-2-(dimethy...)
Affinity DataIC50: 2.80E+4nMAssay Description:Inhibition of Bacillus anthracis anthrax lethal factor by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetBotulinum neurotoxin type A(Clostridium botulinum)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308036(2-(4-(2-Chloro-4-cyanophenoxy)phenyl)-6-(4,5-dihyd...)
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition of Clostridium botulinum toxin BoNT/A light chain by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetLethal factor(Bacillus anthracis)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50100895(2-(4-(4-carbamimidoylphenoxy)phenyl)-1H-indole-6-c...)
Affinity DataIC50: 3.50E+4nMAssay Description:Inhibition of Bacillus anthracis anthrax lethal factor by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetLethal factor(Bacillus anthracis)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308038(6-(4,5-Dihydro-1H-imidazol-2-yl)-2-(4-fluorophenyl...)
Affinity DataIC50: 4.00E+4nMAssay Description:Inhibition of Bacillus anthracis anthrax lethal factor by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetBotulinum neurotoxin type A(Clostridium botulinum)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308034(6-(1,4,5,6-Tetrahydropyrimidin-2-yl)-2-(4-(4-(1,4,...)
Affinity DataIC50: 4.10E+4nMAssay Description:Inhibition of Clostridium botulinum toxin BoNT/A light chain by HPLC-based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetBotulinum neurotoxin type A(Clostridium botulinum)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50378659(CHEMBL354449)
Affinity DataIC50: 4.30E+4nMAssay Description:Inhibition of Clostridium botulinum toxin BoNT/A light chain by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetBotulinum neurotoxin type A(Clostridium botulinum)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308039(6-(1,4,5,6-Tetrahydropyrimidin-2-yl)-2-(4-(4-(1,4,...)
Affinity DataIC50: 4.30E+4nMAssay Description:Inhibition of Clostridium botulinum toxin BoNT/A light chain by HPLC-based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetLethal factor(Bacillus anthracis)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308040(6-(4,5-Dihydro-1H-imidazol-2-yl)-2-{4-[4-(4,5-dihy...)
Affinity DataIC50: 4.30E+4nMAssay Description:Inhibition of Bacillus anthracis anthrax lethal factor by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetBotulinum neurotoxin type A(Clostridium botulinum)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308041(2-(4-Methoxyphenyl)-6-(4,5-dihydro-1H-imidazol-2-y...)
Affinity DataIC50: 4.50E+4nMAssay Description:Inhibition of Clostridium botulinum toxin BoNT/A light chain by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetLethal factor(Bacillus anthracis)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308042(2-(4-Fluorophenyl)-1H-indole-6-carboximidamide | C...)
Affinity DataIC50: 4.80E+4nMAssay Description:Inhibition of Bacillus anthracis anthrax lethal factor by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetLethal factor(Bacillus anthracis)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50378658(CHEMBL164837)
Affinity DataIC50: 4.90E+4nMAssay Description:Inhibition of Bacillus anthracis anthrax lethal factor by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetLethal factor(Bacillus anthracis)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308043(6-Chloro-2-(4-(4-(4,5-dihydro-1H-imidazol-2-yl)phe...)
Affinity DataIC50: 5.10E+4nMAssay Description:Inhibition of Bacillus anthracis anthrax lethal factor by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetBotulinum neurotoxin type A(Clostridium botulinum)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308032(2-(4-(2,4-Dichlorophenoxy)phenyl)-6-(4,5-dihydro-1...)
Affinity DataIC50: 5.20E+4nMAssay Description:Inhibition of Clostridium botulinum toxin BoNT/A light chain by HPLC-based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetBotulinum neurotoxin type A(Clostridium botulinum)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308044(2-(4-(4-(6-(1,4,5,6-Tetrahydropyrimidin-2-yl)benzo...)
Affinity DataIC50: 5.40E+4nMAssay Description:Inhibition of Clostridium botulinum toxin BoNT/A light chain by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetLethal factor(Bacillus anthracis)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308045(6-(4,5-Dihydroimidazol-2-yl)-2-(5-(4-(4,5-dihydroi...)
Affinity DataIC50: 5.50E+4nMAssay Description:Inhibition of Bacillus anthracis anthrax lethal factor by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetBotulinum neurotoxin type A(Clostridium botulinum)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308046(N1-(6-(6-(4,5-Dihydro-1H-imidazol-2-yl)benzo[b]thi...)
Affinity DataIC50: 5.60E+4nMAssay Description:Inhibition of Clostridium botulinum toxin BoNT/A light chain by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetLethal factor(Bacillus anthracis)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308041(2-(4-Methoxyphenyl)-6-(4,5-dihydro-1H-imidazol-2-y...)
Affinity DataIC50: 6.10E+4nMAssay Description:Inhibition of Bacillus anthracis anthrax lethal factor by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetBotulinum neurotoxin type A(Clostridium botulinum)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308047(6-(3,4,5,6-Tetrahydropyrimidin-2-yl)-2-(4-(4-(3,2,...)
Affinity DataIC50: 6.70E+4nMAssay Description:Inhibition of Clostridium botulinum toxin BoNT/A light chain by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetBotulinum neurotoxin type A(Clostridium botulinum)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308045(6-(4,5-Dihydroimidazol-2-yl)-2-(5-(4-(4,5-dihydroi...)
Affinity DataIC50: 6.90E+4nMAssay Description:Inhibition of Clostridium botulinum toxin BoNT/A light chain by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetLethal factor(Bacillus anthracis)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308052(2-(4-Fluorophenyl)-1H-indole-6-carbonitrile | CHEM...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of Bacillus anthracis anthrax lethal factor by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetLethal factor(Bacillus anthracis)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308049(2-(4-(4-Carbamoylphenoxy)phenyl)-1H-indole-6-carbo...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of Bacillus anthracis anthrax lethal factor by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetLethal factor(Bacillus anthracis)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308057(2-(4-(4-Cyanophenoxy)phenyl)-1H-indole-6-carboximi...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of Bacillus anthracis anthrax lethal factor by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetLethal factor(Bacillus anthracis)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308039(6-(1,4,5,6-Tetrahydropyrimidin-2-yl)-2-(4-(4-(1,4,...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of Bacillus anthracis anthrax lethal factor by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetLethal factor(Bacillus anthracis)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308058(2-(4-(4-(6-(5-Hydroxy-1,4,5,6-tetrahydropyrimidin-...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of Bacillus anthracis anthrax lethal factor by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetLethal factor(Bacillus anthracis)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308050(2-(5-(4-Cyanophenoxy)pyridin-2-yl)-1H-indole-6-car...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of Bacillus anthracis anthrax lethal factor by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetLethal factor(Bacillus anthracis)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308047(6-(3,4,5,6-Tetrahydropyrimidin-2-yl)-2-(4-(4-(3,2,...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of Bacillus anthracis anthrax lethal factor by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetLethal factor(Bacillus anthracis)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308036(2-(4-(2-Chloro-4-cyanophenoxy)phenyl)-6-(4,5-dihyd...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of Bacillus anthracis anthrax lethal factor by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetLethal factor(Bacillus anthracis)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308044(2-(4-(4-(6-(1,4,5,6-Tetrahydropyrimidin-2-yl)benzo...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of Bacillus anthracis anthrax lethal factor by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetLethal factor(Bacillus anthracis)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308032(2-(4-(2,4-Dichlorophenoxy)phenyl)-6-(4,5-dihydro-1...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of Bacillus anthracis anthrax lethal factor by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetBotulinum neurotoxin type A(Clostridium botulinum)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308045(6-(4,5-Dihydroimidazol-2-yl)-2-(5-(4-(4,5-dihydroi...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of Clostridium botulinum toxin BoNT/A light chain by HPLC-based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetLethal factor(Bacillus anthracis)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308053(2-(4-Fluorophenyl)-1H-indole-6-carboxamide | CHEMB...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of Bacillus anthracis anthrax lethal factor by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
TargetLethal factor(Bacillus anthracis)
Microbiotix

Curated by ChEMBL
LigandPNGBDBM50308054(2-(4-Methoxyphenyl)-1H-indole-6-carboxamide | CHEM...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of Bacillus anthracis anthrax lethal factor by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/28/2012
Entry Details Article
PubMed
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