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Compile Data Set for Download or QSAR

Found 164 hits with Last Name = 'alfei' and Initial = 's'   
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
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50161134
PNG
(4-(aminomethyl)-N-ethyl-5-[ethyl(methyl)-lambda~5~...)
Show SMILES CCNc1cncc(N(C)CC)c1CN
Show InChI InChI=1S/C11H20N4/c1-4-14-10-7-13-8-11(9(10)6-12)15(3)5-2/h7-8,14H,4-6,12H2,1-3H3
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n/an/a 20n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of benzylamine binding to Benzylamine oxidase of porcine serum


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
Amiloride-sensitive amine oxidase [copper-containing]


(Homo sapiens (Human))
BDBM50161146
PNG
(4-(aminomethyl)-5-(dimethyl-lambda~5~-azanyl)-N-me...)
Show SMILES CNc1cncc(N(C)C)c1CN
Show InChI InChI=1S/C9H16N4/c1-11-8-5-12-6-9(13(2)3)7(8)4-10/h5-6,11H,4,10H2,1-3H3
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n/an/a 61n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of putrescine binding to against Diamine oxidase of porcine kidney


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50161149
PNG
(4-(aminomethyl)-N-isopropyl-5-[isopropyl(methyl)-l...)
Show SMILES CC(C)Nc1cncc(N(C)C(C)C)c1CN
Show InChI InChI=1S/C13H24N4/c1-9(2)16-12-7-15-8-13(11(12)6-14)17(5)10(3)4/h7-10,16H,6,14H2,1-5H3
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n/an/a>100n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of benzylamine binding to Benzylamine oxidase of porcine serum


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
Amiloride-sensitive amine oxidase [copper-containing]


(Homo sapiens (Human))
BDBM50161153
PNG
(4-(aminomethyl)-N-methyl-5-(methyl-lambda~5~-azany...)
Show SMILES CNc1cncc(NC)c1CN
Show InChI InChI=1S/C8H14N4/c1-10-7-4-12-5-8(11-2)6(7)3-9/h4-5,10-11H,3,9H2,1-2H3
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n/an/a 120n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of putrescine binding to against Diamine oxidase of porcine kidney


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50370602
PNG
(CHEMBL538353)
Show SMILES CCSc1cncc(SCC)c1CN
Show InChI InChI=1S/C10H16N2S2/c1-3-13-9-6-12-7-10(14-4-2)8(9)5-11/h6-7H,3-5,11H2,1-2H3
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n/an/a 130n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of benzylamine binding to Benzylamine oxidase of porcine serum


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50161150
PNG
(4-{[4-(aminomethyl)-5-(4-hydroxybutoxy)pyridin-3-y...)
Show SMILES NCc1c(OCCCCO)cncc1OCCCCO
Show InChI InChI=1S/C14H24N2O4/c15-9-12-13(19-7-3-1-5-17)10-16-11-14(12)20-8-4-2-6-18/h10-11,17-18H,1-9,15H2
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n/an/a 150n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of benzylamine binding to Benzylamine oxidase of porcine serum


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4D


(Homo sapiens (Human))
BDBM50577800
PNG
(CHEMBL4853419)
Show SMILES COc1ccc(cc1OC1CCCC1)C(\C)=N/OCC(=O)N1CCOCC1
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n/an/a 160n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal 6His-tagged human PDE4D3 expressed in baculovirus infected Sf9 insect cells assessed as reduction in 5'-AMP formation using ...


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113638
BindingDB Entry DOI: 10.7270/Q2348Q7S
More data for this
Ligand-Target Pair
Amiloride-sensitive amine oxidase [copper-containing]


(Homo sapiens (Human))
BDBM50161135
PNG
(4-(aminomethyl)-N-methylpyridin-3-amine dihydrochl...)
Show SMILES CNc1cnccc1CN
Show InChI InChI=1S/C7H11N3/c1-9-7-5-10-3-2-6(7)4-8/h2-3,5,9H,4,8H2,1H3
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n/an/a 160n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of putrescine binding to against Diamine oxidase of porcine kidney


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50161143
PNG
((3,5-diethoxypyridin-4-yl)methylamine dihydrochlor...)
Show SMILES CCOc1cncc(OCC)c1CN
Show InChI InChI=1S/C10H16N2O2/c1-3-13-9-6-12-7-10(14-4-2)8(9)5-11/h6-7H,3-5,11H2,1-2H3
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n/an/a 170n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of benzylamine binding to Benzylamine oxidase of porcine serum


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
Amiloride-sensitive amine oxidase [copper-containing]


(Homo sapiens (Human))
BDBM50161138
PNG
(4-(aminomethyl)pyridin-3-amine dihydrochloride | C...)
Show SMILES NCc1ccncc1N
Show InChI InChI=1S/C6H9N3/c7-3-5-1-2-9-4-6(5)8/h1-2,4H,3,7-8H2
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n/an/a 300n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of putrescine binding to against Diamine oxidase of porcine kidney


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50161146
PNG
(4-(aminomethyl)-5-(dimethyl-lambda~5~-azanyl)-N-me...)
Show SMILES CNc1cncc(N(C)C)c1CN
Show InChI InChI=1S/C9H16N4/c1-11-8-5-12-6-9(13(2)3)7(8)4-10/h5-6,11H,4,10H2,1-3H3
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n/an/a 440n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of benzylamine binding to Benzylamine oxidase of porcine serum


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4D


(Homo sapiens (Human))
BDBM50577801
PNG
(CHEMBL4862157)
Show SMILES COc1ccc(cc1OC1CCCC1)C(\C)=N/OCC(=O)N1CC(C)OC(C)C1
PDB

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n/an/a 470n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal 6His-tagged human PDE4D3 expressed in baculovirus infected Sf9 insect cells assessed as reduction in 5'-AMP formation using ...


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113638
BindingDB Entry DOI: 10.7270/Q2348Q7S
More data for this
Ligand-Target Pair
Amiloride-sensitive amine oxidase [copper-containing]


(Homo sapiens (Human))
BDBM50161132
PNG
(4-(aminomethyl)-N-ethylpyridin-3-amine dihydrochlo...)
Show SMILES CCNc1cnccc1CN
Show InChI InChI=1S/C8H13N3/c1-2-11-8-6-10-4-3-7(8)5-9/h3-4,6,11H,2,5,9H2,1H3
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n/an/a 500n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of putrescine binding to against Diamine oxidase of porcine kidney


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
Primary amine oxidase


(Pisum sativum)
BDBM50161135
PNG
(4-(aminomethyl)-N-methylpyridin-3-amine dihydrochl...)
Show SMILES CNc1cnccc1CN
Show InChI InChI=1S/C7H11N3/c1-9-7-5-10-3-2-6(7)4-8/h2-3,5,9H,4,8H2,1H3
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n/an/a 710n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of putrescine binding to pea seedling amine oxidase


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4D


(Homo sapiens (Human))
BDBM50577804
PNG
(CHEMBL4852484)
Show SMILES COc1ccc(cc1OC1CCCC1)C(\C)=N/OCC(O)CN1CCOCC1
PDB

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n/an/a 720n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal 6His-tagged human PDE4D3 expressed in baculovirus infected Sf9 insect cells assessed as reduction in 5'-AMP formation using ...


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113638
BindingDB Entry DOI: 10.7270/Q2348Q7S
More data for this
Ligand-Target Pair
Amiloride-sensitive amine oxidase [copper-containing]


(Homo sapiens (Human))
BDBM50161149
PNG
(4-(aminomethyl)-N-isopropyl-5-[isopropyl(methyl)-l...)
Show SMILES CC(C)Nc1cncc(N(C)C(C)C)c1CN
Show InChI InChI=1S/C13H24N4/c1-9(2)16-12-7-15-8-13(11(12)6-14)17(5)10(3)4/h7-10,16H,6,14H2,1-5H3
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n/an/a 1.00E+3n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of putrescine binding to against Diamine oxidase of porcine kidney


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4D


(Homo sapiens (Human))
BDBM50577805
PNG
(CHEMBL4876286)
Show SMILES COc1ccc(cc1OC1CCCC1)C(\C)=N/OCC(O)CN1CC(C)OC(C)C1
PDB

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n/an/a 1.10E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal 6His-tagged human PDE4D3 expressed in baculovirus infected Sf9 insect cells assessed as reduction in 5'-AMP formation using ...


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113638
BindingDB Entry DOI: 10.7270/Q2348Q7S
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50370601
PNG
(CHEMBL539362)
Show SMILES CC(C)(C)Sc1cncc(SC(C)(C)C)c1CN
Show InChI InChI=1S/C14H24N2S2/c1-13(2,3)17-11-8-16-9-12(10(11)7-15)18-14(4,5)6/h8-9H,7,15H2,1-6H3
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n/an/a 1.60E+3n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of benzylamine binding to Benzylamine oxidase of porcine serum


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50161153
PNG
(4-(aminomethyl)-N-methyl-5-(methyl-lambda~5~-azany...)
Show SMILES CNc1cncc(NC)c1CN
Show InChI InChI=1S/C8H14N4/c1-10-7-4-12-5-8(11-2)6(7)3-9/h4-5,10-11H,3,9H2,1-2H3
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n/an/a 1.70E+3n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of benzylamine binding to Benzylamine oxidase of porcine serum


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50161132
PNG
(4-(aminomethyl)-N-ethylpyridin-3-amine dihydrochlo...)
Show SMILES CCNc1cnccc1CN
Show InChI InChI=1S/C8H13N3/c1-2-11-8-6-10-4-3-7(8)5-9/h3-4,6,11H,2,5,9H2,1H3
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n/an/a 2.00E+3n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of benzylamine binding to Benzylamine oxidase of porcine serum


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
Amiloride-sensitive amine oxidase [copper-containing]


(Homo sapiens (Human))
BDBM50161134
PNG
(4-(aminomethyl)-N-ethyl-5-[ethyl(methyl)-lambda~5~...)
Show SMILES CCNc1cncc(N(C)CC)c1CN
Show InChI InChI=1S/C11H20N4/c1-4-14-10-7-13-8-11(9(10)6-12)15(3)5-2/h7-8,14H,4-6,12H2,1-3H3
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n/an/a 2.50E+3n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of putrescine binding to against Diamine oxidase of porcine kidney


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4D


(Homo sapiens (Human))
BDBM50577801
PNG
(CHEMBL4862157)
Show SMILES COc1ccc(cc1OC1CCCC1)C(\C)=N/OCC(=O)N1CC(C)OC(C)C1
PDB

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n/an/a 2.50E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal 6His-tagged human PDE4D catalytic domain (244 to 578 residues) expressed in Escherichia coli BL21(DE3) pLysS cells assessed ...


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113638
BindingDB Entry DOI: 10.7270/Q2348Q7S
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4D


(Homo sapiens (Human))
BDBM50577800
PNG
(CHEMBL4853419)
Show SMILES COc1ccc(cc1OC1CCCC1)C(\C)=N/OCC(=O)N1CCOCC1
PDB

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n/an/a 2.80E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal 6His-tagged human PDE4D catalytic domain (244 to 578 residues) expressed in Escherichia coli BL21(DE3) pLysS cells assessed ...


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113638
BindingDB Entry DOI: 10.7270/Q2348Q7S
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50161136
PNG
(2-{[4-(aminomethyl)-5-(2-hydroxyethoxy)pyridin-3-y...)
Show SMILES NCc1c(OCCO)cncc1OCCO
Show InChI InChI=1S/C10H16N2O4/c11-5-8-9(15-3-1-13)6-12-7-10(8)16-4-2-14/h6-7,13-14H,1-5,11H2
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n/an/a 3.20E+3n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of benzylamine binding to Benzylamine oxidase of porcine serum


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4D


(Homo sapiens (Human))
BDBM50577803
PNG
(CHEMBL4868872)
Show SMILES COc1ccc(cc1OC1CCCC1)C(\C)=N/OCCC(=O)N1CC(C)OC(C)C1
PDB

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n/an/a 3.60E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal 6His-tagged human PDE4D3 expressed in baculovirus infected Sf9 insect cells assessed as reduction in 5'-AMP formation using ...


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113638
BindingDB Entry DOI: 10.7270/Q2348Q7S
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4D


(Homo sapiens (Human))
BDBM50577805
PNG
(CHEMBL4876286)
Show SMILES COc1ccc(cc1OC1CCCC1)C(\C)=N/OCC(O)CN1CC(C)OC(C)C1
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n/an/a 4.10E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal 6His-tagged human PDE4D catalytic domain (244 to 578 residues) expressed in Escherichia coli BL21(DE3) pLysS cells assessed ...


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113638
BindingDB Entry DOI: 10.7270/Q2348Q7S
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4D


(Homo sapiens (Human))
BDBM50577803
PNG
(CHEMBL4868872)
Show SMILES COc1ccc(cc1OC1CCCC1)C(\C)=N/OCCC(=O)N1CC(C)OC(C)C1
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n/an/a 4.60E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal 6His-tagged human PDE4D catalytic domain (244 to 578 residues) expressed in Escherichia coli BL21(DE3) pLysS cells assessed ...


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113638
BindingDB Entry DOI: 10.7270/Q2348Q7S
More data for this
Ligand-Target Pair
Amiloride-sensitive amine oxidase [copper-containing]


(Homo sapiens (Human))
BDBM50161147
PNG
(4-(aminomethyl)-N-cyclopropylpyridin-3-amine dihyd...)
Show SMILES NCc1ccncc1NC1CC1
Show InChI InChI=1S/C9H13N3/c10-5-7-3-4-11-6-9(7)12-8-1-2-8/h3-4,6,8,12H,1-2,5,10H2
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n/an/a 5.00E+3n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of putrescine binding to against Diamine oxidase of porcine kidney


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50161131
PNG
(CHEMBL536951 | [3-(benzyloxy)-5-ethoxypyridin-4-yl...)
Show SMILES CCOc1cncc(OCc2ccccc2)c1CN
Show InChI InChI=1S/C15H18N2O2/c1-2-18-14-9-17-10-15(13(14)8-16)19-11-12-6-4-3-5-7-12/h3-7,9-10H,2,8,11,16H2,1H3
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n/an/a 5.00E+3n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of benzylamine binding to Benzylamine oxidase of porcine serum


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50161140
PNG
(4-(aminomethyl)-N-(cyclohexylmethyl)pyridin-3-amin...)
Show SMILES NCc1ccncc1NCC1CCCCC1
Show InChI InChI=1S/C13H21N3/c14-8-12-6-7-15-10-13(12)16-9-11-4-2-1-3-5-11/h6-7,10-11,16H,1-5,8-9,14H2
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n/an/a 5.60E+3n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of benzylamine binding to Benzylamine oxidase of porcine serum


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4D


(Homo sapiens (Human))
BDBM50577804
PNG
(CHEMBL4852484)
Show SMILES COc1ccc(cc1OC1CCCC1)C(\C)=N/OCC(O)CN1CCOCC1
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n/an/a 6.90E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal 6His-tagged human PDE4D catalytic domain (244 to 578 residues) expressed in Escherichia coli BL21(DE3) pLysS cells assessed ...


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113638
BindingDB Entry DOI: 10.7270/Q2348Q7S
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50161135
PNG
(4-(aminomethyl)-N-methylpyridin-3-amine dihydrochl...)
Show SMILES CNc1cnccc1CN
Show InChI InChI=1S/C7H11N3/c1-9-7-5-10-3-2-6(7)4-8/h2-3,5,9H,4,8H2,1H3
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n/an/a 8.00E+3n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of benzylamine binding to Benzylamine oxidase of porcine serum


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
Primary amine oxidase


(Pisum sativum)
BDBM50161132
PNG
(4-(aminomethyl)-N-ethylpyridin-3-amine dihydrochlo...)
Show SMILES CCNc1cnccc1CN
Show InChI InChI=1S/C8H13N3/c1-2-11-8-6-10-4-3-7(8)5-9/h3-4,6,11H,2,5,9H2,1H3
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n/an/a 9.30E+3n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of putrescine binding to Pea seedling amine oxidase


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
Amiloride-sensitive amine oxidase [copper-containing]


(Homo sapiens (Human))
BDBM50161151
PNG
(4-(aminomethyl)-5-[methyl(propyl)-lambda~5~-azanyl...)
Show SMILES CCCNc1cncc(N(C)CCC)c1CN
Show InChI InChI=1S/C13H24N4/c1-4-6-16-12-9-15-10-13(11(12)8-14)17(3)7-5-2/h9-10,16H,4-8,14H2,1-3H3
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n/an/a 1.00E+4n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of putrescine binding to against Diamine oxidase of porcine kidney


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Rattus norvegicus (rat))
BDBM50161151
PNG
(4-(aminomethyl)-5-[methyl(propyl)-lambda~5~-azanyl...)
Show SMILES CCCNc1cncc(N(C)CCC)c1CN
Show InChI InChI=1S/C13H24N4/c1-4-6-16-12-9-15-10-13(11(12)8-14)17(3)7-5-2/h9-10,16H,4-8,14H2,1-3H3
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n/an/a 1.00E+4n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibitory concentration for rat liver Monoamine oxidase A using 5-hydroxytryptamine


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4D


(Homo sapiens (Human))
BDBM50299569
PNG
(3-(cyclopentyloxy)-4-methoxybenzaldehyde O-[2-(2,6...)
Show SMILES COc1ccc(\C=N\OCC(=O)N2CC(C)OC(C)C2)cc1OC1CCCC1
Show InChI InChI=1S/C21H30N2O5/c1-15-12-23(13-16(2)27-15)21(24)14-26-22-11-17-8-9-19(25-3)20(10-17)28-18-6-4-5-7-18/h8-11,15-16,18H,4-7,12-14H2,1-3H3/b22-11+
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TBA

Assay Description
Inhibition of C-terminal 6His-tagged human PDE4D3 expressed in baculovirus infected Sf9 insect cells assessed as reduction in 5'-AMP formation using ...


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113638
BindingDB Entry DOI: 10.7270/Q2348Q7S
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4D


(Homo sapiens (Human))
BDBM50577802
PNG
(CHEMBL4862518)
Show SMILES COc1ccc(cc1OC1CCCC1)C(\C)=N/OCCC(=O)N1CCOCC1
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n/an/a 1.12E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal 6His-tagged human PDE4D3 expressed in baculovirus infected Sf9 insect cells assessed as reduction in 5'-AMP formation using ...


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113638
BindingDB Entry DOI: 10.7270/Q2348Q7S
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4D


(Homo sapiens (Human))
BDBM50299569
PNG
(3-(cyclopentyloxy)-4-methoxybenzaldehyde O-[2-(2,6...)
Show SMILES COc1ccc(\C=N\OCC(=O)N2CC(C)OC(C)C2)cc1OC1CCCC1
Show InChI InChI=1S/C21H30N2O5/c1-15-12-23(13-16(2)27-15)21(24)14-26-22-11-17-8-9-19(25-3)20(10-17)28-18-6-4-5-7-18/h8-11,15-16,18H,4-7,12-14H2,1-3H3/b22-11+
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n/an/a 1.60E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal 6His-tagged human PDE4D catalytic domain (244 to 578 residues) expressed in Escherichia coli BL21(DE3) pLysS cells assessed ...


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113638
BindingDB Entry DOI: 10.7270/Q2348Q7S
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50161139
PNG
(4-(aminomethyl)-N-cyclopentylpyridin-3-amine dihyd...)
Show SMILES NCc1ccncc1NC1CCCC1
Show InChI InChI=1S/C11H17N3/c12-7-9-5-6-13-8-11(9)14-10-3-1-2-4-10/h5-6,8,10,14H,1-4,7,12H2
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n/an/a 1.60E+4n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of benzylamine binding to Benzylamine oxidase of porcine serum


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
Amiloride-sensitive amine oxidase [copper-containing]


(Homo sapiens (Human))
BDBM50161152
PNG
(4-(aminomethyl)-N-isopropylpyridin-3-amine dihydro...)
Show SMILES CC(C)Nc1cnccc1CN
Show InChI InChI=1S/C9H15N3/c1-7(2)12-9-6-11-4-3-8(9)5-10/h3-4,6-7,12H,5,10H2,1-2H3
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n/an/a 1.60E+4n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of putrescine binding to Diamine oxidase of porcine kidney


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
Amiloride-sensitive amine oxidase [copper-containing]


(Homo sapiens (Human))
BDBM50161148
PNG
(4-(aminomethyl)-N-cyclohexylpyridin-3-amine dihydr...)
Show SMILES NCc1ccncc1NC1CCCCC1
Show InChI InChI=1S/C12H19N3/c13-8-10-6-7-14-9-12(10)15-11-4-2-1-3-5-11/h6-7,9,11,15H,1-5,8,13H2
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n/an/a 1.60E+4n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of putrescine binding to against Diamine oxidase of porcine kidney


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50161138
PNG
(4-(aminomethyl)pyridin-3-amine dihydrochloride | C...)
Show SMILES NCc1ccncc1N
Show InChI InChI=1S/C6H9N3/c7-3-5-1-2-9-4-6(5)8/h1-2,4H,3,7-8H2
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n/an/a 1.60E+4n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of benzylamine binding to Benzylamine oxidase of porcine serum


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
Primary amine oxidase


(Pisum sativum)
BDBM50161146
PNG
(4-(aminomethyl)-5-(dimethyl-lambda~5~-azanyl)-N-me...)
Show SMILES CNc1cncc(N(C)C)c1CN
Show InChI InChI=1S/C9H16N4/c1-11-8-5-12-6-9(13(2)3)7(8)4-10/h5-6,11H,4,10H2,1-3H3
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n/an/a 1.70E+4n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of putrescine binding to Pea seedling amine oxidase


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
Amiloride-sensitive amine oxidase [copper-containing]


(Homo sapiens (Human))
BDBM50161133
PNG
(4-(aminomethyl)-N-cycloheptylpyridin-3-amine dihyd...)
Show SMILES NCc1ccncc1NC1CCCCCC1
Show InChI InChI=1S/C13H21N3/c14-9-11-7-8-15-10-13(11)16-12-5-3-1-2-4-6-12/h7-8,10,12,16H,1-6,9,14H2
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n/an/a 1.80E+4n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of putrescine binding to against Diamine oxidase of porcine kidney


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
Amiloride-sensitive amine oxidase [copper-containing]


(Homo sapiens (Human))
BDBM50161139
PNG
(4-(aminomethyl)-N-cyclopentylpyridin-3-amine dihyd...)
Show SMILES NCc1ccncc1NC1CCCC1
Show InChI InChI=1S/C11H17N3/c12-7-9-5-6-13-8-11(9)14-10-3-1-2-4-10/h5-6,8,10,14H,1-4,7,12H2
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n/an/a 1.90E+4n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of putrescine binding to against Diamine oxidase of porcine kidney


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Rattus norvegicus (rat))
BDBM50161151
PNG
(4-(aminomethyl)-5-[methyl(propyl)-lambda~5~-azanyl...)
Show SMILES CCCNc1cncc(N(C)CCC)c1CN
Show InChI InChI=1S/C13H24N4/c1-4-6-16-12-9-15-10-13(11(12)8-14)17(3)7-5-2/h9-10,16H,4-8,14H2,1-3H3
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n/an/a 2.00E+4n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibitory concentration for rat liver Monoamine oxidase B using beta-phenylethylamine


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4D


(Homo sapiens (Human))
BDBM50577802
PNG
(CHEMBL4862518)
Show SMILES COc1ccc(cc1OC1CCCC1)C(\C)=N/OCCC(=O)N1CCOCC1
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n/an/a 3.31E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of C-terminal 6His-tagged human PDE4D catalytic domain (244 to 578 residues) expressed in Escherichia coli BL21(DE3) pLysS cells assessed ...


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113638
BindingDB Entry DOI: 10.7270/Q2348Q7S
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Rattus norvegicus (rat))
BDBM50161146
PNG
(4-(aminomethyl)-5-(dimethyl-lambda~5~-azanyl)-N-me...)
Show SMILES CNc1cncc(N(C)C)c1CN
Show InChI InChI=1S/C9H16N4/c1-11-8-5-12-6-9(13(2)3)7(8)4-10/h5-6,11H,4,10H2,1-3H3
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n/an/a 4.40E+4n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibitory concentration for rat liver Monoamine oxidase A using 5-hydroxytryptamine


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
Amiloride-sensitive amine oxidase [copper-containing]


(Homo sapiens (Human))
BDBM50161140
PNG
(4-(aminomethyl)-N-(cyclohexylmethyl)pyridin-3-amin...)
Show SMILES NCc1ccncc1NCC1CCCCC1
Show InChI InChI=1S/C13H21N3/c14-8-12-6-7-15-10-13(12)16-9-11-4-2-1-3-5-11/h6-7,10-11,16H,1-5,8-9,14H2
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n/an/a 5.00E+4n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of putrescine binding to against Diamine oxidase of porcine kidney


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
Peroxisomal primary amine oxidase


(Pichia angusta)
BDBM50161135
PNG
(4-(aminomethyl)-N-methylpyridin-3-amine dihydrochl...)
Show SMILES CNc1cnccc1CN
Show InChI InChI=1S/C7H11N3/c1-9-7-5-10-3-2-6(7)4-8/h2-3,5,9H,4,8H2,1H3
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.30E+4n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of phenylethylamine binding to Hansenula polymorpha amine oxidase


J Med Chem 48: 664-70 (2005)


Article DOI: 10.1021/jm0408316
BindingDB Entry DOI: 10.7270/Q2GF0V9T
More data for this
Ligand-Target Pair
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