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Compile Data Set for Download or QSAR

Found 6 hits Enz. Inhib. hit(s) with all data for entry = 50006335   
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] B


(Bos taurus)
BDBM50036731
PNG
(3-Dimethylamino-1-phenyl-propan-1-one | CHEMBL5011...)
Show SMILES CN(C)CCC(=O)c1ccccc1
Show InChI InChI=1S/C11H15NO/c1-12(2)9-8-11(13)10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3
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PubMed
3.50E+5n/an/an/an/an/an/an/an/a



Northwestern University

Curated by ChEMBL


Assay Description
Inhibition of Monoamine oxidase-B from Bovine liver


J Med Chem 36: 1711-5 (1993)


BindingDB Entry DOI: 10.7270/Q2DN443D
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Bos taurus)
BDBM50047897
PNG
(CHEMBL289199 | Dimethyl-(3-phenyl-propyl)-amine)
Show SMILES CN(C)CCCc1ccccc1
Show InChI InChI=1S/C11H17N/c1-12(2)10-6-9-11-7-4-3-5-8-11/h3-5,7-8H,6,9-10H2,1-2H3
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3.80E+5n/an/an/an/an/an/an/an/a



Northwestern University

Curated by ChEMBL


Assay Description
Inhibition of Monoamine oxidase-B from Bovine liver


J Med Chem 36: 1711-5 (1993)


BindingDB Entry DOI: 10.7270/Q2DN443D
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Bos taurus)
BDBM50047898
PNG
(CHEMBL47794 | Dimethyl-pentyl-amine)
Show SMILES CCCCCN(C)C
Show InChI InChI=1S/C7H17N/c1-4-5-6-7-8(2)3/h4-7H2,1-3H3
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2.10E+6n/an/an/an/an/an/an/an/a



Northwestern University

Curated by ChEMBL


Assay Description
Inhibition of Monoamine oxidase-B from Bovine liver


J Med Chem 36: 1711-5 (1993)


BindingDB Entry DOI: 10.7270/Q2DN443D
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Bos taurus)
BDBM50047896
PNG
(CHEMBL46232 | Phenethyl-propyl-amine)
Show SMILES CCCNCCc1ccccc1
Show InChI InChI=1S/C11H17N/c1-2-9-12-10-8-11-6-4-3-5-7-11/h3-7,12H,2,8-10H2,1H3
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PubMed
4.00E+6n/an/an/an/an/an/an/an/a



Northwestern University

Curated by ChEMBL


Assay Description
Inhibition of Monoamine oxidase-B from Bovine liver


J Med Chem 36: 1711-5 (1993)


BindingDB Entry DOI: 10.7270/Q2DN443D
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Bos taurus)
BDBM50018453
PNG
(CHEMBL46278 | Dimethyl-phenethyl-amine | N,N-dimet...)
Show SMILES CN(C)CCc1ccccc1
Show InChI InChI=1S/C10H15N/c1-11(2)9-8-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3
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7.10E+6n/an/an/an/an/an/an/an/a



Northwestern University

Curated by ChEMBL


Assay Description
Inhibition of Monoamine oxidase-B from Bovine liver


J Med Chem 36: 1711-5 (1993)


BindingDB Entry DOI: 10.7270/Q2DN443D
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Bos taurus)
BDBM50016907
PNG
(CHEMBL46841 | Dimethyl-(4-phenyl-butyl)-amine)
Show SMILES CN(C)CCCCc1ccccc1
Show InChI InChI=1S/C12H19N/c1-13(2)11-7-6-10-12-8-4-3-5-9-12/h3-5,8-9H,6-7,10-11H2,1-2H3
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PubMed
1.00E+7n/an/an/an/an/an/an/an/a



Northwestern University

Curated by ChEMBL


Assay Description
Inhibition of Monoamine oxidase-B from Bovine liver


J Med Chem 36: 1711-5 (1993)


BindingDB Entry DOI: 10.7270/Q2DN443D
More data for this
Ligand-Target Pair