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Compile Data Set for Download or QSAR

Found 206 hits Enz. Inhib. hit(s) with all data for entry = 50009841   
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
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50532731
PNG
(CHEMBL4571763)
Show SMILES Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4ccccc4)C3)ccc12
Show InChI InChI=1S/C24H27NO3/c1-17-18(2)24(26)28-23-13-21(10-11-22(17)23)27-16-20-9-6-12-25(15-20)14-19-7-4-3-5-8-19/h3-5,7-8,10-11,13,20H,6,9,12,14-16H2,1-2H3
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1.37E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Mixed-type inhibition of electric eel AChE using S-acetylthiocholine as substrate preincubated for 20 mins followed by substrate addition measured fo...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50532731
PNG
(CHEMBL4571763)
Show SMILES Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4ccccc4)C3)ccc12
Show InChI InChI=1S/C24H27NO3/c1-17-18(2)24(26)28-23-13-21(10-11-22(17)23)27-16-20-9-6-12-25(15-20)14-19-7-4-3-5-8-19/h3-5,7-8,10-11,13,20H,6,9,12,14-16H2,1-2H3
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1.37E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Mixed-type inhibition of electric eel AChE using S-acetylthiocholine as substrate preincubated for 20 mins followed by substrate addition measured fo...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM15581
PNG
(CHEMBL8706 | CLG | CLORGILINE | Clorgyline | N-[3-...)
Show SMILES CN(CCCOc1ccc(Cl)cc1Cl)CC#C
Show InChI InChI=1S/C13H15Cl2NO/c1-3-7-16(2)8-4-9-17-13-6-5-11(14)10-12(13)15/h1,5-6,10H,4,7-9H2,2H3
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n/an/a 2.5n/an/an/an/an/an/a



Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOA expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM15581
PNG
(CHEMBL8706 | CLG | CLORGILINE | Clorgyline | N-[3-...)
Show SMILES CN(CCCOc1ccc(Cl)cc1Cl)CC#C
Show InChI InChI=1S/C13H15Cl2NO/c1-3-7-16(2)8-4-9-17-13-6-5-11(14)10-12(13)15/h1,5-6,10H,4,7-9H2,2H3
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n/an/a 2.5n/an/an/an/an/an/a



Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOA expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM8960
PNG
((+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimet...)
Show SMILES COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC
Show InChI InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3
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n/an/a 21n/an/an/an/an/an/a



Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition measured for 5 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM8960
PNG
((+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimet...)
Show SMILES COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC
Show InChI InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3
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n/an/a 21n/an/an/an/an/an/a



Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition measured for 5 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532731
PNG
(CHEMBL4571763)
Show SMILES Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4ccccc4)C3)ccc12
Show InChI InChI=1S/C24H27NO3/c1-17-18(2)24(26)28-23-13-21(10-11-22(17)23)27-16-20-9-6-12-25(15-20)14-19-7-4-3-5-8-19/h3-5,7-8,10-11,13,20H,6,9,12,14-16H2,1-2H3
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n/an/a 23n/an/an/an/an/an/a



Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532731
PNG
(CHEMBL4571763)
Show SMILES Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4ccccc4)C3)ccc12
Show InChI InChI=1S/C24H27NO3/c1-17-18(2)24(26)28-23-13-21(10-11-22(17)23)27-16-20-9-6-12-25(15-20)14-19-7-4-3-5-8-19/h3-5,7-8,10-11,13,20H,6,9,12,14-16H2,1-2H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532731
PNG
(CHEMBL4571763)
Show SMILES Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4ccccc4)C3)ccc12
Show InChI InChI=1S/C24H27NO3/c1-17-18(2)24(26)28-23-13-21(10-11-22(17)23)27-16-20-9-6-12-25(15-20)14-19-7-4-3-5-8-19/h3-5,7-8,10-11,13,20H,6,9,12,14-16H2,1-2H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532731
PNG
(CHEMBL4571763)
Show SMILES Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4ccccc4)C3)ccc12
Show InChI InChI=1S/C24H27NO3/c1-17-18(2)24(26)28-23-13-21(10-11-22(17)23)27-16-20-9-6-12-25(15-20)14-19-7-4-3-5-8-19/h3-5,7-8,10-11,13,20H,6,9,12,14-16H2,1-2H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532727
PNG
(CHEMBL4460538)
Show SMILES Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4cccc(Br)c4)C3)ccc12
Show InChI InChI=1S/C24H26BrNO3/c1-16-17(2)24(27)29-23-12-21(8-9-22(16)23)28-15-19-6-4-10-26(14-19)13-18-5-3-7-20(25)11-18/h3,5,7-9,11-12,19H,4,6,10,13-15H2,1-2H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532727
PNG
(CHEMBL4460538)
Show SMILES Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4cccc(Br)c4)C3)ccc12
Show InChI InChI=1S/C24H26BrNO3/c1-16-17(2)24(27)29-23-12-21(8-9-22(16)23)28-15-19-6-4-10-26(14-19)13-18-5-3-7-20(25)11-18/h3,5,7-9,11-12,19H,4,6,10,13-15H2,1-2H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532727
PNG
(CHEMBL4460538)
Show SMILES Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4cccc(Br)c4)C3)ccc12
Show InChI InChI=1S/C24H26BrNO3/c1-16-17(2)24(27)29-23-12-21(8-9-22(16)23)28-15-19-6-4-10-26(14-19)13-18-5-3-7-20(25)11-18/h3,5,7-9,11-12,19H,4,6,10,13-15H2,1-2H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532727
PNG
(CHEMBL4460538)
Show SMILES Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4cccc(Br)c4)C3)ccc12
Show InChI InChI=1S/C24H26BrNO3/c1-16-17(2)24(27)29-23-12-21(8-9-22(16)23)28-15-19-6-4-10-26(14-19)13-18-5-3-7-20(25)11-18/h3,5,7-9,11-12,19H,4,6,10,13-15H2,1-2H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532731
PNG
(CHEMBL4571763)
Show SMILES Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4ccccc4)C3)ccc12
Show InChI InChI=1S/C24H27NO3/c1-17-18(2)24(26)28-23-13-21(10-11-22(17)23)27-16-20-9-6-12-25(15-20)14-19-7-4-3-5-8-19/h3-5,7-8,10-11,13,20H,6,9,12,14-16H2,1-2H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532731
PNG
(CHEMBL4571763)
Show SMILES Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4ccccc4)C3)ccc12
Show InChI InChI=1S/C24H27NO3/c1-17-18(2)24(26)28-23-13-21(10-11-22(17)23)27-16-20-9-6-12-25(15-20)14-19-7-4-3-5-8-19/h3-5,7-8,10-11,13,20H,6,9,12,14-16H2,1-2H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532730
PNG
(CHEMBL4455029)
Show SMILES Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4ccc(cc4)C#N)C3)ccc12
Show InChI InChI=1S/C25H26N2O3/c1-17-18(2)25(28)30-24-12-22(9-10-23(17)24)29-16-21-4-3-11-27(15-21)14-20-7-5-19(13-26)6-8-20/h5-10,12,21H,3-4,11,14-16H2,1-2H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532730
PNG
(CHEMBL4455029)
Show SMILES Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4ccc(cc4)C#N)C3)ccc12
Show InChI InChI=1S/C25H26N2O3/c1-17-18(2)25(28)30-24-12-22(9-10-23(17)24)29-16-21-4-3-11-27(15-21)14-20-7-5-19(13-26)6-8-20/h5-10,12,21H,3-4,11,14-16H2,1-2H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532737
PNG
(CHEMBL4447506)
Show SMILES Cl.Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4cccc(Cl)c4)C3)ccc12
Show InChI InChI=1S/C24H26ClNO3.ClH/c1-16-17(2)24(27)29-23-12-21(8-9-22(16)23)28-15-19-6-4-10-26(14-19)13-18-5-3-7-20(25)11-18;/h3,5,7-9,11-12,19H,4,6,10,13-15H2,1-2H3;1H
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532737
PNG
(CHEMBL4447506)
Show SMILES Cl.Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4cccc(Cl)c4)C3)ccc12
Show InChI InChI=1S/C24H26ClNO3.ClH/c1-16-17(2)24(27)29-23-12-21(8-9-22(16)23)28-15-19-6-4-10-26(14-19)13-18-5-3-7-20(25)11-18;/h3,5,7-9,11-12,19H,4,6,10,13-15H2,1-2H3;1H
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532722
PNG
(CHEMBL4446787)
Show SMILES Cl.Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4ccc(Cl)cc4)C3)ccc12
Show InChI InChI=1S/C24H26ClNO3.ClH/c1-16-17(2)24(27)29-23-12-21(9-10-22(16)23)28-15-19-4-3-11-26(14-19)13-18-5-7-20(25)8-6-18;/h5-10,12,19H,3-4,11,13-15H2,1-2H3;1H
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532722
PNG
(CHEMBL4446787)
Show SMILES Cl.Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4ccc(Cl)cc4)C3)ccc12
Show InChI InChI=1S/C24H26ClNO3.ClH/c1-16-17(2)24(27)29-23-12-21(9-10-22(16)23)28-15-19-4-3-11-26(14-19)13-18-5-7-20(25)8-6-18;/h5-10,12,19H,3-4,11,13-15H2,1-2H3;1H
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532721
PNG
(CHEMBL4539659)
Show SMILES Cl.Cc1c(C)c(=O)oc2cc(OCC3CCN(Cc4cccc(Cl)c4)CC3)ccc12
Show InChI InChI=1S/C24H26ClNO3/c1-16-17(2)24(27)29-23-13-21(6-7-22(16)23)28-15-18-8-10-26(11-9-18)14-19-4-3-5-20(25)12-19/h3-7,12-13,18H,8-11,14-15H2,1-2H3
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n/an/a 89n/an/an/an/an/an/a



Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532721
PNG
(CHEMBL4539659)
Show SMILES Cl.Cc1c(C)c(=O)oc2cc(OCC3CCN(Cc4cccc(Cl)c4)CC3)ccc12
Show InChI InChI=1S/C24H26ClNO3/c1-16-17(2)24(27)29-23-13-21(6-7-22(16)23)28-15-18-8-10-26(11-9-18)14-19-4-3-5-20(25)12-19/h3-7,12-13,18H,8-11,14-15H2,1-2H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532733
PNG
(CHEMBL4556552)
Show SMILES COc1ccc(CN2CCCC(COc3ccc4c(C)c(C)c(=O)oc4c3)C2)cc1OC
Show InChI InChI=1S/C26H31NO5/c1-17-18(2)26(28)32-24-13-21(8-9-22(17)24)31-16-20-6-5-11-27(15-20)14-19-7-10-23(29-3)25(12-19)30-4/h7-10,12-13,20H,5-6,11,14-16H2,1-4H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532733
PNG
(CHEMBL4556552)
Show SMILES COc1ccc(CN2CCCC(COc3ccc4c(C)c(C)c(=O)oc4c3)C2)cc1OC
Show InChI InChI=1S/C26H31NO5/c1-17-18(2)26(28)32-24-13-21(8-9-22(17)24)31-16-20-6-5-11-27(15-20)14-19-7-10-23(29-3)25(12-19)30-4/h7-10,12-13,20H,5-6,11,14-16H2,1-4H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532726
PNG
(CHEMBL4472789)
Show SMILES Cl.Cc1c(C)c(=O)oc2cc(OCC3CCN(Cc4ccccc4)CC3)ccc12
Show InChI InChI=1S/C24H27NO3/c1-17-18(2)24(26)28-23-14-21(8-9-22(17)23)27-16-20-10-12-25(13-11-20)15-19-6-4-3-5-7-19/h3-9,14,20H,10-13,15-16H2,1-2H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532726
PNG
(CHEMBL4472789)
Show SMILES Cl.Cc1c(C)c(=O)oc2cc(OCC3CCN(Cc4ccccc4)CC3)ccc12
Show InChI InChI=1S/C24H27NO3/c1-17-18(2)24(26)28-23-14-21(8-9-22(17)23)27-16-20-10-12-25(13-11-20)15-19-6-4-3-5-7-19/h3-9,14,20H,10-13,15-16H2,1-2H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532727
PNG
(CHEMBL4460538)
Show SMILES Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4cccc(Br)c4)C3)ccc12
Show InChI InChI=1S/C24H26BrNO3/c1-16-17(2)24(27)29-23-12-21(8-9-22(16)23)28-15-19-6-4-10-26(14-19)13-18-5-3-7-20(25)11-18/h3,5,7-9,11-12,19H,4,6,10,13-15H2,1-2H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532727
PNG
(CHEMBL4460538)
Show SMILES Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4cccc(Br)c4)C3)ccc12
Show InChI InChI=1S/C24H26BrNO3/c1-16-17(2)24(27)29-23-12-21(8-9-22(16)23)28-15-19-6-4-10-26(14-19)13-18-5-3-7-20(25)11-18/h3,5,7-9,11-12,19H,4,6,10,13-15H2,1-2H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532720
PNG
(CHEMBL4527319)
Show SMILES Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4ccc(cc4)S(C)(=O)=O)C3)ccc12
Show InChI InChI=1S/C25H29NO5S/c1-17-18(2)25(27)31-24-13-21(8-11-23(17)24)30-16-20-5-4-12-26(15-20)14-19-6-9-22(10-7-19)32(3,28)29/h6-11,13,20H,4-5,12,14-16H2,1-3H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532720
PNG
(CHEMBL4527319)
Show SMILES Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4ccc(cc4)S(C)(=O)=O)C3)ccc12
Show InChI InChI=1S/C25H29NO5S/c1-17-18(2)25(27)31-24-13-21(8-11-23(17)24)30-16-20-5-4-12-26(15-20)14-19-6-9-22(10-7-19)32(3,28)29/h6-11,13,20H,4-5,12,14-16H2,1-3H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532736
PNG
(CHEMBL4564297)
Show SMILES Cc1c(C)c(=O)oc2cc(OC3CCN(CC(=O)c4ccccc4)CC3)ccc12
Show InChI InChI=1S/C24H25NO4/c1-16-17(2)24(27)29-23-14-20(8-9-21(16)23)28-19-10-12-25(13-11-19)15-22(26)18-6-4-3-5-7-18/h3-9,14,19H,10-13,15H2,1-2H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532736
PNG
(CHEMBL4564297)
Show SMILES Cc1c(C)c(=O)oc2cc(OC3CCN(CC(=O)c4ccccc4)CC3)ccc12
Show InChI InChI=1S/C24H25NO4/c1-16-17(2)24(27)29-23-14-20(8-9-21(16)23)28-19-10-12-25(13-11-19)15-22(26)18-6-4-3-5-7-18/h3-9,14,19H,10-13,15H2,1-2H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532729
PNG
(CHEMBL4441966)
Show SMILES Cl.CN1CCCC(COc2ccc3c(C)c(C)c(=O)oc3c2)C1
Show InChI InChI=1S/C18H23NO3.ClH/c1-12-13(2)18(20)22-17-9-15(6-7-16(12)17)21-11-14-5-4-8-19(3)10-14;/h6-7,9,14H,4-5,8,10-11H2,1-3H3;1H
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532729
PNG
(CHEMBL4441966)
Show SMILES Cl.CN1CCCC(COc2ccc3c(C)c(C)c(=O)oc3c2)C1
Show InChI InChI=1S/C18H23NO3.ClH/c1-12-13(2)18(20)22-17-9-15(6-7-16(12)17)21-11-14-5-4-8-19(3)10-14;/h6-7,9,14H,4-5,8,10-11H2,1-3H3;1H
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532725
PNG
(CHEMBL4439320)
Show SMILES Cl.Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4ccc(F)cc4)C3)ccc12
Show InChI InChI=1S/C24H26FNO3.ClH/c1-16-17(2)24(27)29-23-12-21(9-10-22(16)23)28-15-19-4-3-11-26(14-19)13-18-5-7-20(25)8-6-18;/h5-10,12,19H,3-4,11,13-15H2,1-2H3;1H
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532725
PNG
(CHEMBL4439320)
Show SMILES Cl.Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4ccc(F)cc4)C3)ccc12
Show InChI InChI=1S/C24H26FNO3.ClH/c1-16-17(2)24(27)29-23-12-21(9-10-22(16)23)28-15-19-4-3-11-26(14-19)13-18-5-7-20(25)8-6-18;/h5-10,12,19H,3-4,11,13-15H2,1-2H3;1H
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50532720
PNG
(CHEMBL4527319)
Show SMILES Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4ccc(cc4)S(C)(=O)=O)C3)ccc12
Show InChI InChI=1S/C25H29NO5S/c1-17-18(2)25(27)31-24-13-21(8-11-23(17)24)30-16-20-5-4-12-26(15-20)14-19-6-9-22(10-7-19)32(3,28)29/h6-11,13,20H,4-5,12,14-16H2,1-3H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOA expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50532720
PNG
(CHEMBL4527319)
Show SMILES Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4ccc(cc4)S(C)(=O)=O)C3)ccc12
Show InChI InChI=1S/C25H29NO5S/c1-17-18(2)25(27)31-24-13-21(8-11-23(17)24)30-16-20-5-4-12-26(15-20)14-19-6-9-22(10-7-19)32(3,28)29/h6-11,13,20H,4-5,12,14-16H2,1-3H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOA expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532724
PNG
(CHEMBL4441456)
Show SMILES CN1CCC(CC1)Oc1ccc2c(C)c(C)c(=O)oc2c1
Show InChI InChI=1S/C17H21NO3/c1-11-12(2)17(19)21-16-10-14(4-5-15(11)16)20-13-6-8-18(3)9-7-13/h4-5,10,13H,6-9H2,1-3H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532724
PNG
(CHEMBL4441456)
Show SMILES CN1CCC(CC1)Oc1ccc2c(C)c(C)c(=O)oc2c1
Show InChI InChI=1S/C17H21NO3/c1-11-12(2)17(19)21-16-10-14(4-5-15(11)16)20-13-6-8-18(3)9-7-13/h4-5,10,13H,6-9H2,1-3H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532734
PNG
(CHEMBL4466718)
Show SMILES Cc1c(C)c(=O)oc2cc(OC3CCN(Cc4cccc(Cl)c4)CC3)ccc12
Show InChI InChI=1S/C23H24ClNO3/c1-15-16(2)23(26)28-22-13-20(6-7-21(15)22)27-19-8-10-25(11-9-19)14-17-4-3-5-18(24)12-17/h3-7,12-13,19H,8-11,14H2,1-2H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532734
PNG
(CHEMBL4466718)
Show SMILES Cc1c(C)c(=O)oc2cc(OC3CCN(Cc4cccc(Cl)c4)CC3)ccc12
Show InChI InChI=1S/C23H24ClNO3/c1-15-16(2)23(26)28-22-13-20(6-7-21(15)22)27-19-8-10-25(11-9-19)14-17-4-3-5-18(24)12-17/h3-7,12-13,19H,8-11,14H2,1-2H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532738
PNG
(CHEMBL4451548)
Show SMILES Cl.CN1CCC(COc2ccc3c(C)c(C)c(=O)oc3c2)CC1
Show InChI InChI=1S/C18H23NO3/c1-12-13(2)18(20)22-17-10-15(4-5-16(12)17)21-11-14-6-8-19(3)9-7-14/h4-5,10,14H,6-9,11H2,1-3H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532738
PNG
(CHEMBL4451548)
Show SMILES Cl.CN1CCC(COc2ccc3c(C)c(C)c(=O)oc3c2)CC1
Show InChI InChI=1S/C18H23NO3/c1-12-13(2)18(20)22-17-10-15(4-5-16(12)17)21-11-14-6-8-19(3)9-7-14/h4-5,10,14H,6-9,11H2,1-3H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50506899
PNG
(CHEMBL4574355)
Show SMILES Cc1c(C)c(=O)oc2cc(OCCCN3CCc4ccccc4C3)ccc12
Show InChI InChI=1S/C23H25NO3/c1-16-17(2)23(25)27-22-14-20(8-9-21(16)22)26-13-5-11-24-12-10-18-6-3-4-7-19(18)15-24/h3-4,6-9,14H,5,10-13,15H2,1-2H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50506899
PNG
(CHEMBL4574355)
Show SMILES Cc1c(C)c(=O)oc2cc(OCCCN3CCc4ccccc4C3)ccc12
Show InChI InChI=1S/C23H25NO3/c1-16-17(2)23(25)27-22-14-20(8-9-21(16)22)26-13-5-11-24-12-10-18-6-3-4-7-19(18)15-24/h3-4,6-9,14H,5,10-13,15H2,1-2H3
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Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532718
PNG
(CHEMBL4569054)
Show SMILES Cc1c(C)c(=O)oc2cc(OC3CCN(Cc4ccccc4)CC3)ccc12
Show InChI InChI=1S/C23H25NO3/c1-16-17(2)23(25)27-22-14-20(8-9-21(16)22)26-19-10-12-24(13-11-19)15-18-6-4-3-5-7-18/h3-9,14,19H,10-13,15H2,1-2H3
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n/an/a 445n/an/an/an/an/an/a



Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50532718
PNG
(CHEMBL4569054)
Show SMILES Cc1c(C)c(=O)oc2cc(OC3CCN(Cc4ccccc4)CC3)ccc12
Show InChI InChI=1S/C23H25NO3/c1-16-17(2)23(25)27-22-14-20(8-9-21(16)22)26-19-10-12-24(13-11-19)15-18-6-4-3-5-7-18/h3-9,14,19H,10-13,15H2,1-2H3
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n/an/a 445n/an/an/an/an/an/a



Universit£ degli Studi di Bari "Aldo Moro"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB expressed in microsomes of baculovirus-infected insect cell using kynuramine as substrate preincubated for 20 mi...


J Med Chem 59: 6791-806 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00562
BindingDB Entry DOI: 10.7270/Q25142Q8
More data for this
Ligand-Target Pair
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