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Compile Data Set for Download or QSAR

Found 84 hits Enz. Inhib. hit(s) with all data for entry = 4669   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81643
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 1k)
Show SMILES COc1ccc(C2CC(=NN2C(C)=O)c2ccccc2O)c(OC)c1 |c:8|
Show InChI InChI=1S/C19H20N2O4/c1-12(22)21-17(15-9-8-13(24-2)10-19(15)25-3)11-16(20-21)14-6-4-5-7-18(14)23/h4-10,17,23H,11H2,1-3H3
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Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81639
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 1g)
Show SMILES CC(=O)N1N=C(CC1c1ccc(Cl)cc1)c1ccccc1O |c:4|
Show InChI InChI=1S/C17H15ClN2O2/c1-11(21)20-16(12-6-8-13(18)9-7-12)10-15(19-20)14-4-2-3-5-17(14)22/h2-9,16,22H,10H2,1H3
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Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50164871
PNG
(1-(3,5-Diphenyl-4,5-dihydro-pyrazol-1-yl)-ethanone...)
Show SMILES CC(=O)N1N=C(CC1c1ccccc1)c1ccccc1 |c:4|
Show InChI InChI=1S/C17H16N2O/c1-13(20)19-17(15-10-6-3-7-11-15)12-16(18-19)14-8-4-2-5-9-14/h2-11,17H,12H2,1H3
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Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81642
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 1j)
Show SMILES COc1ccc(C2CC(=NN2C(C)=O)c2ccccc2)c(OC)c1 |c:8|
Show InChI InChI=1S/C19H20N2O3/c1-13(22)21-18(12-17(20-21)14-7-5-4-6-8-14)16-10-9-15(23-2)11-19(16)24-3/h4-11,18H,12H2,1-3H3
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Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81659
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 3c)
Show SMILES CC(=O)N1CCC(=N1)c1ccc(Cl)cc1 |c:6|
Show InChI InChI=1S/C11H11ClN2O/c1-8(15)14-7-6-11(13-14)9-2-4-10(12)5-3-9/h2-5H,6-7H2,1H3
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Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50297427
PNG
(1-(5-(3,4-dimethoxyphenyl)-3-phenyl-4,5-dihydro-1H...)
Show SMILES COc1ccc(cc1OC)C1CC(=NN1C(C)=O)c1ccccc1 |c:13|
Show InChI InChI=1S/C19H20N2O3/c1-13(22)21-17(12-16(20-21)14-7-5-4-6-8-14)15-9-10-18(23-2)19(11-15)24-3/h4-11,17H,12H2,1-3H3
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Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81638
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 1e)
Show SMILES CC(=O)N1N=C(CC1c1ccccc1C)c1c(O)cccc1O |c:4|
Show InChI InChI=1S/C18H18N2O3/c1-11-6-3-4-7-13(11)15-10-14(19-20(15)12(2)21)18-16(22)8-5-9-17(18)23/h3-9,15,22-23H,10H2,1-2H3
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Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81660
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 3d)
Show SMILES CC(=O)N1CCC(=N1)c1ccc(Br)cc1 |c:6|
Show InChI InChI=1S/C11H11BrN2O/c1-8(15)14-7-6-11(13-14)9-2-4-10(12)5-3-9/h2-5H,6-7H2,1H3
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Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81652
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 2i)
Show SMILES COc1cccc(c1)C1=NN(CC1)c1ccccc1 |t:9|
Show InChI InChI=1S/C16H16N2O/c1-19-15-9-5-6-13(12-15)16-10-11-18(17-16)14-7-3-2-4-8-14/h2-9,12H,10-11H2,1H3
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Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50297422
PNG
(1-(3-(2,6-dihydroxyphenyl)-5-m-tolyl-4,5-dihydro-1...)
Show SMILES CC(=O)N1N=C(CC1c1cccc(C)c1)c1c(O)cccc1O |c:4|
Show InChI InChI=1S/C18H18N2O3/c1-11-5-3-6-13(9-11)15-10-14(19-20(15)12(2)21)18-16(22)7-4-8-17(18)23/h3-9,15,22-23H,10H2,1-2H3
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Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81666
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 3l)
Show SMILES CC(=O)N1CCC(=N1)c1ccc(O)cc1 |c:6|
Show InChI InChI=1S/C11H12N2O2/c1-8(14)13-7-6-11(12-13)9-2-4-10(15)5-3-9/h2-5,15H,6-7H2,1H3
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Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50297422
PNG
(1-(3-(2,6-dihydroxyphenyl)-5-m-tolyl-4,5-dihydro-1...)
Show SMILES CC(=O)N1N=C(CC1c1cccc(C)c1)c1c(O)cccc1O |c:4|
Show InChI InChI=1S/C18H18N2O3/c1-11-5-3-6-13(9-11)15-10-14(19-20(15)12(2)21)18-16(22)7-4-8-17(18)23/h3-9,15,22-23H,10H2,1-2H3
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Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81651
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 2g)
Show SMILES Oc1ccccc1C1=NN(CC1)c1ccccc1 |t:8|
Show InChI InChI=1S/C15H14N2O/c18-15-9-5-4-8-13(15)14-10-11-17(16-14)12-6-2-1-3-7-12/h1-9,18H,10-11H2
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Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50297423
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 2h | 4-(1-ph...)
Show SMILES Oc1ccc(cc1)C1=NN(CC1)c1ccccc1 |t:8|
Show InChI InChI=1S/C15H14N2O/c18-14-8-6-12(7-9-14)15-10-11-17(16-15)13-4-2-1-3-5-13/h1-9,18H,10-11H2
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Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81654
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 2k)
Show SMILES O=N(=O)c1ccc(cc1)C1=NN(CC1)c1ccccc1 |t:10|
Show InChI InChI=1S/C15H13N3O2/c19-18(20)14-8-6-12(7-9-14)15-10-11-17(16-15)13-4-2-1-3-5-13/h1-9H,10-11H2
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Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81645
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 1n)
Show SMILES COc1ccc(cc1OC)C1CC(=NN1C(C)=O)c1ccccc1O |c:13|
Show InChI InChI=1S/C19H20N2O4/c1-12(22)21-16(13-8-9-18(24-2)19(10-13)25-3)11-15(20-21)14-6-4-5-7-17(14)23/h4-10,16,23H,11H2,1-3H3
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Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81644
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 1l)
Show SMILES COc1ccc(C2CC(=NN2C(C)=O)c2ccc(O)cc2O)c(OC)c1 |c:8|
Show InChI InChI=1S/C19H20N2O5/c1-11(22)21-17(15-7-5-13(25-2)9-19(15)26-3)10-16(20-21)14-6-4-12(23)8-18(14)24/h4-9,17,23-24H,10H2,1-3H3
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Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81641
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 1i)
Show SMILES COc1ccc(cc1)C1CC(=NN1C(C)=O)c1c(O)cccc1O |c:11|
Show InChI InChI=1S/C18H18N2O4/c1-11(21)20-15(12-6-8-13(24-2)9-7-12)10-14(19-20)18-16(22)4-3-5-17(18)23/h3-9,15,22-23H,10H2,1-2H3
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Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50297429
PNG
(1-(3-phenyl-5-o-tolyl-4,5-dihydro-1H-pyrazol-1-yl)...)
Show SMILES CC(=O)N1N=C(CC1c1ccccc1C)c1ccccc1 |c:4|
Show InChI InChI=1S/C18H18N2O/c1-13-8-6-7-11-16(13)18-12-17(19-20(18)14(2)21)15-9-4-3-5-10-15/h3-11,18H,12H2,1-2H3
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Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50297428
PNG
(1-(3-(2,4-dihydroxyphenyl)-5-phenyl-4,5-dihydro-1H...)
Show SMILES CC(=O)N1N=C(CC1c1ccccc1)c1ccc(O)cc1O |c:4|
Show InChI InChI=1S/C17H16N2O3/c1-11(20)19-16(12-5-3-2-4-6-12)10-15(18-19)14-8-7-13(21)9-17(14)22/h2-9,16,21-22H,10H2,1H3
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Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM81638
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 1e)
Show SMILES CC(=O)N1N=C(CC1c1ccccc1C)c1c(O)cccc1O |c:4|
Show InChI InChI=1S/C18H18N2O3/c1-11-6-3-4-7-13(11)15-10-14(19-20(15)12(2)21)18-16(22)8-5-9-17(18)23/h3-9,15,22-23H,10H2,1-2H3
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Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81669
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 3o)
Show SMILES CC(=O)N1CCC(=N1)c1ccccc1O |c:6|
Show InChI InChI=1S/C11H12N2O2/c1-8(14)13-7-6-10(12-13)9-4-2-3-5-11(9)15/h2-5,15H,6-7H2,1H3
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Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81668
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 3n)
Show SMILES CC(=O)N1CCC(=N1)c1ccc(O)c(O)c1O |c:6|
Show InChI InChI=1S/C11H12N2O4/c1-6(14)13-5-4-8(12-13)7-2-3-9(15)11(17)10(7)16/h2-3,15-17H,4-5H2,1H3
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Università degli Studi di Roma



Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81667
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 3m)
Show SMILES CC(=O)N1CCC(=N1)c1ccc(O)cc1O |c:6|
Show InChI InChI=1S/C11H12N2O3/c1-7(14)13-5-4-10(12-13)9-3-2-8(15)6-11(9)16/h2-3,6,15-16H,4-5H2,1H3
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Università degli Studi di Roma



Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50297433
PNG
(1-(3-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-...)
Show SMILES COc1ccc(cc1OC)C1=NN(CC1)C(C)=O |t:11|
Show InChI InChI=1S/C13H16N2O3/c1-9(16)15-7-6-11(14-15)10-4-5-12(17-2)13(8-10)18-3/h4-5,8H,6-7H2,1-3H3
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Università degli Studi di Roma



Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81658
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 3b)
Show SMILES CC(=O)N1CCC(=N1)c1ccc(C)cc1 |c:6|
Show InChI InChI=1S/C12H14N2O/c1-9-3-5-11(6-4-9)12-7-8-14(13-12)10(2)15/h3-6H,7-8H2,1-2H3
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Università degli Studi di Roma



Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81657
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 3a)
Show SMILES CC(=O)N1CCC(=N1)c1ccccc1 |c:6|
Show InChI InChI=1S/C11H12N2O/c1-9(14)13-8-7-11(12-13)10-5-3-2-4-6-10/h2-6H,7-8H2,1H3
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Università degli Studi di Roma



Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81653
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 2j)
Show SMILES COc1ccc(cc1)C1=NN(CC1)c1ccccc1 |t:9|
Show InChI InChI=1S/C16H16N2O/c1-19-15-9-7-13(8-10-15)16-11-12-18(17-16)14-5-3-2-4-6-14/h2-10H,11-12H2,1H3
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Università degli Studi di Roma



Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50297435
PNG
(1-(3-(2,5-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-...)
Show SMILES COc1ccc(OC)c(c1)C1=NN(CC1)C(C)=O |t:11|
Show InChI InChI=1S/C13H16N2O3/c1-9(16)15-7-6-12(14-15)11-8-10(17-2)4-5-13(11)18-3/h4-5,8H,6-7H2,1-3H3
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Università degli Studi di Roma



Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81661
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 3e)
Show SMILES COc1ccc(cc1)C1=NN(CC1)C(C)=O |t:9|
Show InChI InChI=1S/C12H14N2O2/c1-9(15)14-8-7-12(13-14)10-3-5-11(16-2)6-4-10/h3-6H,7-8H2,1-2H3
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Università degli Studi di Roma



Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81664
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 3h)
Show SMILES COc1ccc(C2=NN(CC2)C(C)=O)c(OC)c1 |t:6|
Show InChI InChI=1S/C13H16N2O3/c1-9(16)15-7-6-12(14-15)11-5-4-10(17-2)8-13(11)18-3/h4-5,8H,6-7H2,1-3H3
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Università degli Studi di Roma



Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81662
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 3f)
Show SMILES COc1cccc(c1)C1=NN(CC1)C(C)=O |t:9|
Show InChI InChI=1S/C12H14N2O2/c1-9(15)14-7-6-12(13-14)10-4-3-5-11(8-10)16-2/h3-5,8H,6-7H2,1-2H3
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Università degli Studi di Roma



Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81663
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 3g)
Show SMILES COc1ccccc1C1=NN(CC1)C(C)=O |t:9|
Show InChI InChI=1S/C12H14N2O2/c1-9(15)14-8-7-11(13-14)10-5-3-4-6-12(10)16-2/h3-6H,7-8H2,1-2H3
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Università degli Studi di Roma



Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81665
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 3k)
Show SMILES CC(=O)N1CCC(=N1)c1ccccc1N(=O)=O |c:6|
Show InChI InChI=1S/C11H11N3O3/c1-8(15)13-7-6-10(12-13)9-4-2-3-5-11(9)14(16)17/h2-5H,6-7H2,1H3
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Università degli Studi di Roma



Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81637
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 1c)
Show SMILES CC(=O)N1N=C(CC1c1ccccc1)c1c(O)cccc1O |c:4|
Show InChI InChI=1S/C17H16N2O3/c1-11(20)19-14(12-6-3-2-4-7-12)10-13(18-19)17-15(21)8-5-9-16(17)22/h2-9,14,21-22H,10H2,1H3
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Università degli Studi di Roma



Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM81652
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 2i)
Show SMILES COc1cccc(c1)C1=NN(CC1)c1ccccc1 |t:9|
Show InChI InChI=1S/C16H16N2O/c1-19-15-9-5-6-13(12-15)16-10-11-18(17-16)14-7-3-2-4-8-14/h2-9,12H,10-11H2,1H3
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Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM81654
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 2k)
Show SMILES O=N(=O)c1ccc(cc1)C1=NN(CC1)c1ccccc1 |t:10|
Show InChI InChI=1S/C15H13N3O2/c19-18(20)14-8-6-12(7-9-14)15-10-11-17(16-15)13-4-2-1-3-5-13/h1-9H,10-11H2
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Università degli Studi di Roma



Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81655
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 2l)
Show SMILES COc1ccc(C2=NN(CC2)c2ccccc2)c(OC)c1 |t:6|
Show InChI InChI=1S/C17H18N2O2/c1-20-14-8-9-15(17(12-14)21-2)16-10-11-19(18-16)13-6-4-3-5-7-13/h3-9,12H,10-11H2,1-2H3
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Università degli Studi di Roma



Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81640
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 1h)
Show SMILES CC(=O)N1N=C(CC1c1ccc(Cl)cc1)c1c(O)cccc1O |c:4|
Show InChI InChI=1S/C17H15ClN2O3/c1-10(21)20-14(11-5-7-12(18)8-6-11)9-13(19-20)17-15(22)3-2-4-16(17)23/h2-8,14,22-23H,9H2,1H3
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Università degli Studi di Roma



Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50297423
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 2h | 4-(1-ph...)
Show SMILES Oc1ccc(cc1)C1=NN(CC1)c1ccccc1 |t:8|
Show InChI InChI=1S/C15H14N2O/c18-14-8-6-12(7-9-14)15-10-11-17(16-15)13-4-2-1-3-5-13/h1-9,18H,10-11H2
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Università degli Studi di Roma



Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81656
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 2m)
Show SMILES COc1ccc(cc1OC)C1=NN(CC1)c1ccccc1 |t:11|
Show InChI InChI=1S/C17H18N2O2/c1-20-16-9-8-13(12-17(16)21-2)15-10-11-19(18-15)14-6-4-3-5-7-14/h3-9,12H,10-11H2,1-2H3
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Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50297431
PNG
(1-phenyl-3-p-tolyl-4,5-dihydro-1H-pyrazole | 4,5-D...)
Show SMILES Cc1ccc(cc1)C1=NN(CC1)c1ccccc1 |t:8|
Show InChI InChI=1S/C16H16N2/c1-13-7-9-14(10-8-13)16-11-12-18(17-16)15-5-3-2-4-6-15/h2-10H,11-12H2,1H3
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Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81649
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 2d)
Show SMILES Brc1ccc(cc1)C1=NN(CC1)c1ccccc1 |t:8|
Show InChI InChI=1S/C15H13BrN2/c16-13-8-6-12(7-9-13)15-10-11-18(17-15)14-4-2-1-3-5-14/h1-9H,10-11H2
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Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81646
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 2a)
Show SMILES C1CC(=NN1c1ccccc1)c1ccccc1 |c:2|
Show InChI InChI=1S/C15H14N2/c1-3-7-13(8-4-1)15-11-12-17(16-15)14-9-5-2-6-10-14/h1-10H,11-12H2
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Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81648
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 2c)
Show SMILES Clc1ccc(cc1)C1=NN(CC1)c1ccccc1 |t:8|
Show InChI InChI=1S/C15H13ClN2/c16-13-8-6-12(7-9-13)15-10-11-18(17-15)14-4-2-1-3-5-14/h1-9H,10-11H2
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n/an/a 9.90E+3n/an/an/an/an/an/a



Università degli Studi di Roma



Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM81647
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 2b)
Show SMILES Clc1ccccc1C1=NN(CC1)c1ccccc1 |t:8|
Show InChI InChI=1S/C15H13ClN2/c16-14-9-5-4-8-13(14)15-10-11-18(17-15)12-6-2-1-3-7-12/h1-9H,10-11H2
PDB

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PubMed
n/an/a 1.00E+4n/an/an/an/an/an/a



Università degli Studi di Roma



Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM81653
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 2j)
Show SMILES COc1ccc(cc1)C1=NN(CC1)c1ccccc1 |t:9|
Show InChI InChI=1S/C16H16N2O/c1-19-15-9-7-13(8-10-15)16-11-12-18(17-16)14-5-3-2-4-6-14/h2-10H,11-12H2,1H3
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PubMed
n/an/a 1.25E+4n/an/an/an/an/an/a



Università degli Studi di Roma



Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM81656
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 2m)
Show SMILES COc1ccc(cc1OC)C1=NN(CC1)c1ccccc1 |t:11|
Show InChI InChI=1S/C17H18N2O2/c1-20-16-9-8-13(12-17(16)21-2)15-10-11-19(18-15)14-6-4-3-5-7-14/h3-9,12H,10-11H2,1-2H3
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PubMed
n/an/a 1.70E+4n/an/an/an/an/an/a



Università degli Studi di Roma



Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM81669
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 3o)
Show SMILES CC(=O)N1CCC(=N1)c1ccccc1O |c:6|
Show InChI InChI=1S/C11H12N2O2/c1-8(14)13-7-6-10(12-13)9-4-2-3-5-11(9)15/h2-5,15H,6-7H2,1H3
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UniChem

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Article
PubMed
n/an/a 1.90E+4n/an/an/an/an/an/a



Università degli Studi di Roma



Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM81658
PNG
(4,5-Dihydro-(1H)-pyrazole derivative, 3b)
Show SMILES CC(=O)N1CCC(=N1)c1ccc(C)cc1 |c:6|
Show InChI InChI=1S/C12H14N2O/c1-9-3-5-11(6-4-9)12-7-8-14(13-12)10(2)15/h3-6H,7-8H2,1-2H3
PDB

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UniChem

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Article
PubMed
n/an/a 2.00E+4n/an/an/an/an/an/a



Università degli Studi di Roma



Assay Description
Monoamine oxidase inhibitory activity of derivatives of 4, dihydro-(1H)-pyrazole.


Chem Biol Drug Des 67: 206-14 (2006)


Article DOI: 10.1111/j.1747-0285.2006.00367.x
BindingDB Entry DOI: 10.7270/Q26W98JB
More data for this
Ligand-Target Pair
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