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Compile Data Set for Download or QSAR

Found 5 hits Enz. Inhib. hit(s) with all data for entry = 50003227   
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
Peroxisomal N(1)-acetyl-spermine/spermidine oxidase


(Homo sapiens (Human))
BDBM50015358
PNG
(CHEMBL417844 | N,N'-BIS(2,3-BUTADIENYL)-1,4-BUTANE...)
Show SMILES C=C=CCNCCCCNCC=C=C
Show InChI InChI=1S/C12H20N2/c1-3-5-9-13-11-7-8-12-14-10-6-4-2/h5-6,13-14H,1-2,7-12H2
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PubMed
90n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity measured as apparent dissociation constant against Polyamine oxidase (PAO) from pig liver


J Med Chem 28: 1-2 (1985)


BindingDB Entry DOI: 10.7270/Q2445KHW
More data for this
Ligand-Target Pair
Peroxisomal N(1)-acetyl-spermine/spermidine oxidase


(Homo sapiens (Human))
BDBM50026232
PNG
(CHEMBL293698 | N-Buta-2,3-dienyl-N'-methyl-butane-...)
Show SMILES CNCCCCNCC=C=C
Show InChI InChI=1S/C9H18N2/c1-3-4-8-11-9-6-5-7-10-2/h4,10-11H,1,5-9H2,2H3
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300n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity measured as apparent dissociation constant against Polyamine oxidase (PAO) from pig liver


J Med Chem 28: 1-2 (1985)


BindingDB Entry DOI: 10.7270/Q2445KHW
More data for this
Ligand-Target Pair
Peroxisomal N(1)-acetyl-spermine/spermidine oxidase


(Homo sapiens (Human))
BDBM50026231
PNG
(CHEMBL59622 | N*1*-Buta-2,3-dienyl-butane-1,4-diam...)
Show SMILES NCCCCNCC=C=C
Show InChI InChI=1S/C8H16N2/c1-2-3-7-10-8-5-4-6-9/h3,10H,1,4-9H2
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700n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity measured as apparent dissociation constant against Polyamine oxidase (PAO) from pig liver


J Med Chem 28: 1-2 (1985)


BindingDB Entry DOI: 10.7270/Q2445KHW
More data for this
Ligand-Target Pair
Peroxisomal N(1)-acetyl-spermine/spermidine oxidase


(Homo sapiens (Human))
BDBM50026230
PNG
(CHEMBL59623 | N-Methyl-N'-prop-2-ynyl-butane-1,4-d...)
Show SMILES CNCCCCNCC#C
Show InChI InChI=1S/C8H16N2/c1-3-6-10-8-5-4-7-9-2/h1,9-10H,4-8H2,2H3
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3.10E+5n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity measured as apparent dissociation constant against Polyamine oxidase (PAO) from pig liver


J Med Chem 28: 1-2 (1985)


BindingDB Entry DOI: 10.7270/Q2445KHW
More data for this
Ligand-Target Pair
Peroxisomal N(1)-acetyl-spermine/spermidine oxidase


(Homo sapiens (Human))
BDBM50026233
PNG
(CHEMBL292770 | N*1*-Prop-2-ynyl-butane-1,4-diamine)
Show SMILES NCCCCNCC#C
Show InChI InChI=1S/C7H14N2/c1-2-6-9-7-4-3-5-8/h1,9H,3-8H2
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4.25E+5n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity measured as apparent dissociation constant against Polyamine oxidase (PAO) from pig liver


J Med Chem 28: 1-2 (1985)


BindingDB Entry DOI: 10.7270/Q2445KHW
More data for this
Ligand-Target Pair