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Found 21 hits of Enz. Inhib. data with enzyme = 'Amine oxidase [flavin-containing] B' and Substrate = 'BDBM10990'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM86779
PNG
(Phthalonitrile analogue, 4h)
Show SMILES Brc1ccc(COc2ccc(C#N)c(c2)C#N)cc1
Show InChI InChI=1S/C15H9BrN2O/c16-14-4-1-11(2-5-14)10-19-15-6-3-12(8-17)13(7-15)9-18/h1-7H,10H2
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n/an/a 4.80n/an/an/an/a7.4-70



North-West University



Assay Description
MAO inhibition potencies of phthalonitrile, benzonitrile and benzyl phenyl ether analogs, recombinant human MAO-A and -B were employed as enzyme sour...


Bioorg Chem 40: 114-24 (2012)


Article DOI: 10.1016/j.bioorg.2011.10.003
BindingDB Entry DOI: 10.7270/Q2W66JB4
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM86776
PNG
(Phthalonitrile analogue, 4e)
Show SMILES N#Cc1ccc(OC\C=C\c2ccccc2)cc1C#N
Show InChI InChI=1S/C17H12N2O/c18-12-15-8-9-17(11-16(15)13-19)20-10-4-7-14-5-2-1-3-6-14/h1-9,11H,10H2/b7-4+
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n/an/a 6.60n/an/an/an/a7.4-70



North-West University



Assay Description
MAO inhibition potencies of phthalonitrile, benzonitrile and benzyl phenyl ether analogs, recombinant human MAO-A and -B were employed as enzyme sour...


Bioorg Chem 40: 114-24 (2012)


Article DOI: 10.1016/j.bioorg.2011.10.003
BindingDB Entry DOI: 10.7270/Q2W66JB4
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM86773
PNG
(Phthalonitrile analogue, 4b)
Show SMILES N#Cc1ccc(OCc2ccccc2)cc1C#N
Show InChI InChI=1S/C15H10N2O/c16-9-13-6-7-15(8-14(13)10-17)18-11-12-4-2-1-3-5-12/h1-8H,11H2
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n/an/a 7.90n/an/an/an/a7.4-70



North-West University



Assay Description
MAO inhibition potencies of phthalonitrile, benzonitrile and benzyl phenyl ether analogs, recombinant human MAO-A and -B were employed as enzyme sour...


Bioorg Chem 40: 114-24 (2012)


Article DOI: 10.1016/j.bioorg.2011.10.003
BindingDB Entry DOI: 10.7270/Q2W66JB4
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM86774
PNG
(Phthalonitrile analogue, 4c)
Show SMILES N#Cc1ccc(OCCc2ccccc2)cc1C#N
Show InChI InChI=1S/C16H12N2O/c17-11-14-6-7-16(10-15(14)12-18)19-9-8-13-4-2-1-3-5-13/h1-7,10H,8-9H2
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n/an/a 18n/an/an/an/a7.4-70



North-West University



Assay Description
MAO inhibition potencies of phthalonitrile, benzonitrile and benzyl phenyl ether analogs, recombinant human MAO-A and -B were employed as enzyme sour...


Bioorg Chem 40: 114-24 (2012)


Article DOI: 10.1016/j.bioorg.2011.10.003
BindingDB Entry DOI: 10.7270/Q2W66JB4
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM86786
PNG
(Benzonitrile analogue, 5f)
Show SMILES Brc1ccc(COc2cccc(c2)C#N)cc1
Show InChI InChI=1S/C14H10BrNO/c15-13-6-4-11(5-7-13)10-17-14-3-1-2-12(8-14)9-16/h1-8H,10H2
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n/an/a 41n/an/an/an/a7.4-70



North-West University



Assay Description
MAO inhibition potencies of phthalonitrile, benzonitrile and benzyl phenyl ether analogs, recombinant human MAO-A and -B were employed as enzyme sour...


Bioorg Chem 40: 114-24 (2012)


Article DOI: 10.1016/j.bioorg.2011.10.003
BindingDB Entry DOI: 10.7270/Q2W66JB4
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM86775
PNG
(Phthalonitrile analogue, 4d)
Show SMILES N#Cc1ccc(OCCCc2ccccc2)cc1C#N
Show InChI InChI=1S/C17H14N2O/c18-12-15-8-9-17(11-16(15)13-19)20-10-4-7-14-5-2-1-3-6-14/h1-3,5-6,8-9,11H,4,7,10H2
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n/an/a 136n/an/an/an/a7.4-70



North-West University



Assay Description
MAO inhibition potencies of phthalonitrile, benzonitrile and benzyl phenyl ether analogs, recombinant human MAO-A and -B were employed as enzyme sour...


Bioorg Chem 40: 114-24 (2012)


Article DOI: 10.1016/j.bioorg.2011.10.003
BindingDB Entry DOI: 10.7270/Q2W66JB4
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM86784
PNG
(Benzonitrile analogue, 5d)
Show SMILES N#Cc1cccc(OC\C=C\c2ccccc2)c1
Show InChI InChI=1S/C16H13NO/c17-13-15-8-4-10-16(12-15)18-11-5-9-14-6-2-1-3-7-14/h1-10,12H,11H2/b9-5+
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n/an/a 174n/an/an/an/a7.4-70



North-West University



Assay Description
MAO inhibition potencies of phthalonitrile, benzonitrile and benzyl phenyl ether analogs, recombinant human MAO-A and -B were employed as enzyme sour...


Bioorg Chem 40: 114-24 (2012)


Article DOI: 10.1016/j.bioorg.2011.10.003
BindingDB Entry DOI: 10.7270/Q2W66JB4
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM86780
PNG
(Phthalonitrile analogue, 4i)
Show SMILES Brc1ccc(CCOc2ccc(C#N)c(c2)C#N)cc1
Show InChI InChI=1S/C16H11BrN2O/c17-15-4-1-12(2-5-15)7-8-20-16-6-3-13(10-18)14(9-16)11-19/h1-6,9H,7-8H2
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n/an/a 226n/an/an/an/a7.4-70



North-West University



Assay Description
MAO inhibition potencies of phthalonitrile, benzonitrile and benzyl phenyl ether analogs, recombinant human MAO-A and -B were employed as enzyme sour...


Bioorg Chem 40: 114-24 (2012)


Article DOI: 10.1016/j.bioorg.2011.10.003
BindingDB Entry DOI: 10.7270/Q2W66JB4
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM86777
PNG
(Phthalonitrile analogue, 4f)
Show SMILES N#Cc1ccc(Oc2ccc3ccccc3c2)cc1C#N
Show InChI InChI=1S/C18H10N2O/c19-11-15-6-8-18(10-16(15)12-20)21-17-7-5-13-3-1-2-4-14(13)9-17/h1-10H
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n/an/a 244n/an/an/an/a7.4-70



North-West University



Assay Description
MAO inhibition potencies of phthalonitrile, benzonitrile and benzyl phenyl ether analogs, recombinant human MAO-A and -B were employed as enzyme sour...


Bioorg Chem 40: 114-24 (2012)


Article DOI: 10.1016/j.bioorg.2011.10.003
BindingDB Entry DOI: 10.7270/Q2W66JB4
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM86782
PNG
(Benzonitrile analogue, 5b)
Show SMILES N#Cc1cccc(OCc2ccccc2)c1
Show InChI InChI=1S/C14H11NO/c15-10-13-7-4-8-14(9-13)16-11-12-5-2-1-3-6-12/h1-9H,11H2
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n/an/a 249n/an/an/an/a7.4-70



North-West University



Assay Description
MAO inhibition potencies of phthalonitrile, benzonitrile and benzyl phenyl ether analogs, recombinant human MAO-A and -B were employed as enzyme sour...


Bioorg Chem 40: 114-24 (2012)


Article DOI: 10.1016/j.bioorg.2011.10.003
BindingDB Entry DOI: 10.7270/Q2W66JB4
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM86785
PNG
(Benzonitrile analogue, 5e)
Show SMILES Brc1ccc(Oc2ccc(cc2)C#N)cc1
Show InChI InChI=1S/C13H8BrNO/c14-11-3-7-13(8-4-11)16-12-5-1-10(9-15)2-6-12/h1-8H
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n/an/a 266n/an/an/an/a7.4-70



North-West University



Assay Description
MAO inhibition potencies of phthalonitrile, benzonitrile and benzyl phenyl ether analogs, recombinant human MAO-A and -B were employed as enzyme sour...


Bioorg Chem 40: 114-24 (2012)


Article DOI: 10.1016/j.bioorg.2011.10.003
BindingDB Entry DOI: 10.7270/Q2W66JB4
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM86783
PNG
(Benzonitrile analogue, 5c)
Show SMILES N#Cc1ccc(OC\C=C\c2ccccc2)cc1
Show InChI InChI=1S/C16H13NO/c17-13-15-8-10-16(11-9-15)18-12-4-7-14-5-2-1-3-6-14/h1-11H,12H2/b7-4+
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n/an/a 379n/an/an/an/a7.4-70



North-West University



Assay Description
MAO inhibition potencies of phthalonitrile, benzonitrile and benzyl phenyl ether analogs, recombinant human MAO-A and -B were employed as enzyme sour...


Bioorg Chem 40: 114-24 (2012)


Article DOI: 10.1016/j.bioorg.2011.10.003
BindingDB Entry DOI: 10.7270/Q2W66JB4
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM86778
PNG
(Phthalonitrile analogue, 4g)
Show SMILES Brc1ccc(Oc2ccc(C#N)c(c2)C#N)cc1
Show InChI InChI=1S/C14H7BrN2O/c15-12-2-5-13(6-3-12)18-14-4-1-10(8-16)11(7-14)9-17/h1-7H
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n/an/a 568n/an/an/an/a7.4-70



North-West University



Assay Description
MAO inhibition potencies of phthalonitrile, benzonitrile and benzyl phenyl ether analogs, recombinant human MAO-A and -B were employed as enzyme sour...


Bioorg Chem 40: 114-24 (2012)


Article DOI: 10.1016/j.bioorg.2011.10.003
BindingDB Entry DOI: 10.7270/Q2W66JB4
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM86781
PNG
(Benzonitrile analogue, 5a)
Show SMILES N#Cc1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C14H11NO/c15-10-12-6-8-14(9-7-12)16-11-13-4-2-1-3-5-13/h1-9H,11H2
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n/an/a 785n/an/an/an/a7.4-70



North-West University



Assay Description
MAO inhibition potencies of phthalonitrile, benzonitrile and benzyl phenyl ether analogs, recombinant human MAO-A and -B were employed as enzyme sour...


Bioorg Chem 40: 114-24 (2012)


Article DOI: 10.1016/j.bioorg.2011.10.003
BindingDB Entry DOI: 10.7270/Q2W66JB4
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM86790
PNG
(Benzyl phenyl ether analogue, 6b)
Show SMILES C(Oc1ccccc1)\C=C\c1ccccc1
Show InChI InChI=1S/C15H14O/c1-3-8-14(9-4-1)10-7-13-16-15-11-5-2-6-12-15/h1-12H,13H2/b10-7+
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n/an/a 1.32E+3n/an/an/an/a7.4-70



North-West University



Assay Description
MAO inhibition potencies of phthalonitrile, benzonitrile and benzyl phenyl ether analogs, recombinant human MAO-A and -B were employed as enzyme sour...


Bioorg Chem 40: 114-24 (2012)


Article DOI: 10.1016/j.bioorg.2011.10.003
BindingDB Entry DOI: 10.7270/Q2W66JB4
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM86787
PNG
(Benzonitrile analogue, 5g)
Show SMILES Brc1ccc(CCOc2ccc(cc2)C#N)cc1
Show InChI InChI=1S/C15H12BrNO/c16-14-5-1-12(2-6-14)9-10-18-15-7-3-13(11-17)4-8-15/h1-8H,9-10H2
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n/an/a 1.35E+3n/an/an/an/a7.4-70



North-West University



Assay Description
MAO inhibition potencies of phthalonitrile, benzonitrile and benzyl phenyl ether analogs, recombinant human MAO-A and -B were employed as enzyme sour...


Bioorg Chem 40: 114-24 (2012)


Article DOI: 10.1016/j.bioorg.2011.10.003
BindingDB Entry DOI: 10.7270/Q2W66JB4
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM86788
PNG
(Benzonitrile analogue, 5h)
Show SMILES N#Cc1ccc(OCCOc2ccccc2)cc1
Show InChI InChI=1S/C15H13NO2/c16-12-13-6-8-15(9-7-13)18-11-10-17-14-4-2-1-3-5-14/h1-9H,10-11H2
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n/an/a 1.39E+3n/an/an/an/a7.4-70



North-West University



Assay Description
MAO inhibition potencies of phthalonitrile, benzonitrile and benzyl phenyl ether analogs, recombinant human MAO-A and -B were employed as enzyme sour...


Bioorg Chem 40: 114-24 (2012)


Article DOI: 10.1016/j.bioorg.2011.10.003
BindingDB Entry DOI: 10.7270/Q2W66JB4
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM86791
PNG
(Benzyl phenyl ether analogue, 6c)
Show SMILES Brc1ccc(COc2ccccc2)cc1
Show InChI InChI=1S/C13H11BrO/c14-12-8-6-11(7-9-12)10-15-13-4-2-1-3-5-13/h1-9H,10H2
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n/an/a 3.05E+3n/an/an/an/a7.4-70



North-West University



Assay Description
MAO inhibition potencies of phthalonitrile, benzonitrile and benzyl phenyl ether analogs, recombinant human MAO-A and -B were employed as enzyme sour...


Bioorg Chem 40: 114-24 (2012)


Article DOI: 10.1016/j.bioorg.2011.10.003
BindingDB Entry DOI: 10.7270/Q2W66JB4
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM86772
PNG
(Phthalonitrile analogue, 4a)
Show SMILES N#Cc1ccc(Oc2ccccc2)cc1C#N
Show InChI InChI=1S/C14H8N2O/c15-9-11-6-7-14(8-12(11)10-16)17-13-4-2-1-3-5-13/h1-8H
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n/an/a 6.02E+3n/an/an/an/a7.4-70



North-West University



Assay Description
MAO inhibition potencies of phthalonitrile, benzonitrile and benzyl phenyl ether analogs, recombinant human MAO-A and -B were employed as enzyme sour...


Bioorg Chem 40: 114-24 (2012)


Article DOI: 10.1016/j.bioorg.2011.10.003
BindingDB Entry DOI: 10.7270/Q2W66JB4
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM86789
PNG
(Benzyl phenyl ether analogue, 6a)
Show SMILES C(Oc1ccccc1)c1ccccc1
Show InChI InChI=1S/C13H12O/c1-3-7-12(8-4-1)11-14-13-9-5-2-6-10-13/h1-10H,11H2
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n/an/a 6.63E+3n/an/an/an/a7.4-70



North-West University



Assay Description
MAO inhibition potencies of phthalonitrile, benzonitrile and benzyl phenyl ether analogs, recombinant human MAO-A and -B were employed as enzyme sour...


Bioorg Chem 40: 114-24 (2012)


Article DOI: 10.1016/j.bioorg.2011.10.003
BindingDB Entry DOI: 10.7270/Q2W66JB4
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM86792
PNG
(Benzyl phenyl ether analogue, 6d)
Show SMILES Brc1ccc(CCOc2ccccc2)cc1
Show InChI InChI=1S/C14H13BrO/c15-13-8-6-12(7-9-13)10-11-16-14-4-2-1-3-5-14/h1-9H,10-11H2
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n/an/a 1.18E+4n/an/an/an/a7.4-70



North-West University



Assay Description
MAO inhibition potencies of phthalonitrile, benzonitrile and benzyl phenyl ether analogs, recombinant human MAO-A and -B were employed as enzyme sour...


Bioorg Chem 40: 114-24 (2012)


Article DOI: 10.1016/j.bioorg.2011.10.003
BindingDB Entry DOI: 10.7270/Q2W66JB4
More data for this
Ligand-Target Pair