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PubMed code 20708306

Compile data set for download or QSAR
Found 68 hits of Enzyme Inhibition Constant Data   
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))		BDBM50378846
PNG
(CHEMBL1258610)
Show SMILES CN(C)c1ccc(cc1)-c1nnc2c(nc3ccccc3n12)C(=O)c1ccccc1
Show InChI InChI=1S/C24H19N5O/c1-28(2)18-14-12-17(13-15-18)23-26-27-24-21(22(30)16-8-4-3-5-9-16)25-19-10-6-7-11-20(19)29(23)24/h3-15H,1-2H3
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n/an/a 2.70n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50378844
PNG
(CHEMBL1258839)
Show SMILES O=C(c1ccccc1)c1nc2ccccc2n2c(nnc12)-c1ccccc1
Show InChI InChI=1S/C22H14N4O/c27-20(15-9-3-1-4-10-15)19-22-25-24-21(16-11-5-2-6-12-16)26(22)18-14-8-7-13-17(18)23-19/h1-14H
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n/an/a 2.70n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50378833
PNG
(CHEMBL1257814)
Show SMILES CC(N=Nc1nc2ccccc2nc1Cc1ccccc1)c1ccc(O)cc1 |w:3.3|
Show InChI InChI=1S/C23H20N4O/c1-16(18-11-13-19(28)14-12-18)26-27-23-22(15-17-7-3-2-4-8-17)24-20-9-5-6-10-21(20)25-23/h2-14,16,28H,15H2,1H3
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n/an/a 2.80n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
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 3.10n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50378834
PNG
(CHEMBL1257932)
Show SMILES Oc1ccc(CN=Nc2nc3ccccc3nc2Cc2ccccc2)cc1 |w:7.7|
Show InChI InChI=1S/C22H18N4O/c27-18-12-10-17(11-13-18)15-23-26-22-21(14-16-6-2-1-3-7-16)24-19-8-4-5-9-20(19)25-22/h1-13,27H,14-15H2
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n/an/a 3.40n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50327216
PNG
(3-Benzyl-2-(2-(2-chlorobenzylidene)hydrazinyl)quin...)
Show SMILES Clc1ccccc1CN=Nc1nc2ccccc2nc1Cc1ccccc1 |w:9.10|
Show InChI InChI=1S/C22H17ClN4/c23-18-11-5-4-10-17(18)15-24-27-22-21(14-16-8-2-1-3-9-16)25-19-12-6-7-13-20(19)26-22/h1-13H,14-15H2
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n/an/a 5.80n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50327220
PNG
(4-Benzyl-1-(2-chlorophenyl)-[1,2,4]triazolo[4,3-a]...)
Show SMILES Clc1ccccc1-c1nnc2c(Cc3ccccc3)nc3ccccc3n12
Show InChI InChI=1S/C22H15ClN4/c23-17-11-5-4-10-16(17)21-25-26-22-19(14-15-8-2-1-3-9-15)24-18-12-6-7-13-20(18)27(21)22/h1-13H,14H2
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n/an/a 6.10n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50327222
PNG
(4-Benzoyl-1-(4-methoxyphenyl)-[1,2,4]triazolo[4,3-...)
Show SMILES COc1ccc(cc1)-c1nnc2c(nc3ccccc3n12)C(=O)c1ccccc1
Show InChI InChI=1S/C23H16N4O2/c1-29-17-13-11-16(12-14-17)22-25-26-23-20(21(28)15-7-3-2-4-8-15)24-18-9-5-6-10-19(18)27(22)23/h2-14H,1H3
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n/an/a 6.20n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50327214
PNG
(2-(2-(Benzo[d][1,3]dioxol-5-ylmethylene)hydrazinyl...)
Show SMILES C(N=Nc1nc2ccccc2nc1Cc1ccccc1)c1ccc2OCOc2c1 |w:2.2|
Show InChI InChI=1S/C23H18N4O2/c1-2-6-16(7-3-1)12-20-23(26-19-9-5-4-8-18(19)25-20)27-24-14-17-10-11-21-22(13-17)29-15-28-21/h1-11,13H,12,14-15H2
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n/an/a 6.30n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50327221
PNG
(4-Benzoyl-1-(3,4-dimethoxyphenyl)-[1,2,4]triazolo[...)
Show SMILES COc1ccc(cc1OC)-c1nnc2c(nc3ccccc3n12)C(=O)c1ccccc1
Show InChI InChI=1S/C24H18N4O3/c1-30-19-13-12-16(14-20(19)31-2)23-26-27-24-21(22(29)15-8-4-3-5-9-15)25-17-10-6-7-11-18(17)28(23)24/h3-14H,1-2H3
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n/an/a 6.80n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50378840
PNG
(CHEMBL1258274)
Show SMILES [O-][N+](=O)c1ccc(CN=Nc2nc3ccccc3nc2Cc2ccccc2)cc1 |w:9.9|
Show InChI InChI=1S/C22H17N5O2/c28-27(29)18-12-10-17(11-13-18)15-23-26-22-21(14-16-6-2-1-3-7-16)24-19-8-4-5-9-20(19)25-22/h1-13H,14-15H2
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n/an/a 8.80n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50327223
PNG
(4-Benzoyl-1-(3-bromo-4-(N,N-dimethylaminophenyl))-...)
Show SMILES CN(C)c1ccc(cc1Br)-c1nnc2c(nc3ccccc3n12)C(=O)c1ccccc1
Show InChI InChI=1S/C24H18BrN5O/c1-29(2)19-13-12-16(14-17(19)25)23-27-28-24-21(22(31)15-8-4-3-5-9-15)26-18-10-6-7-11-20(18)30(23)24/h3-14H,1-2H3
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n/an/a 9.60n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50327219
PNG
(3-Benzyl-2-(2-(3-bromobenzylidene)hydrazinyl)quino...)
Show SMILES Brc1cccc(CN=Nc2nc3ccccc3nc2Cc2ccccc2)c1 |w:8.8|
Show InChI InChI=1S/C22H17BrN4/c23-18-10-6-9-17(13-18)15-24-27-22-21(14-16-7-2-1-3-8-16)25-19-11-4-5-12-20(19)26-22/h1-13H,14-15H2
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n/an/a 9.80n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50378839
PNG
(CHEMBL1258160)
Show SMILES CC(N=Nc1nc2ccccc2nc1Cc1ccccc1)c1ccc(N)cc1 |w:3.3|
Show InChI InChI=1S/C23H21N5/c1-16(18-11-13-19(24)14-12-18)27-28-23-22(15-17-7-3-2-4-8-17)25-20-9-5-6-10-21(20)26-23/h2-14,16H,15,24H2,1H3
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n/an/a 9.80n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50378847
PNG
(CHEMBL1258718)
Show SMILES [O-][N+](=O)c1ccc(cc1)-c1nnc2c(nc3ccccc3n12)C(=O)c1ccccc1
Show InChI InChI=1S/C22H13N5O3/c28-20(14-6-2-1-3-7-14)19-22-25-24-21(15-10-12-16(13-11-15)27(29)30)26(22)18-9-5-4-8-17(18)23-19/h1-13H
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n/an/a 22n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50378851
PNG
(CHEMBL1257341)
Show SMILES COc1cc(cc(OC)c1OC)C(C)N=Nc1nc2ccccc2nc1Cc1ccccc1 |w:15.16|
Show InChI InChI=1S/C26H26N4O3/c1-17(19-15-23(31-2)25(33-4)24(16-19)32-3)29-30-26-22(14-18-10-6-5-7-11-18)27-20-12-8-9-13-21(20)28-26/h5-13,15-17H,14H2,1-4H3
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n/an/a 29n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50378850
PNG
(CHEMBL1257220)
Show SMILES COc1ccc(CN=Nc2nc3ccccc3nc2Cc2ccccc2)cc1OC |w:8.8|
Show InChI InChI=1S/C24H22N4O2/c1-29-22-13-12-18(15-23(22)30-2)16-25-28-24-21(14-17-8-4-3-5-9-17)26-19-10-6-7-11-20(19)27-24/h3-13,15H,14,16H2,1-2H3
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n/an/a 56n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50327217
PNG
(3-Benzyl-2-(2-(4-methoxybenzylidene)hydrazinyl)qui...)
Show SMILES COc1ccc(CN=Nc2nc3ccccc3nc2Cc2ccccc2)cc1 |w:8.8|
Show InChI InChI=1S/C23H20N4O/c1-28-19-13-11-18(12-14-19)16-24-27-23-22(15-17-7-3-2-4-8-17)25-20-9-5-6-10-21(20)26-23/h2-14H,15-16H2,1H3
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n/an/a 63n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50378837
PNG
(CHEMBL1258042)
Show SMILES CC(N=Nc1nc2ccccc2nc1Cc1ccccc1)c1cccs1 |w:3.3|
Show InChI InChI=1S/C21H18N4S/c1-15(20-12-7-13-26-20)24-25-21-19(14-16-8-3-2-4-9-16)22-17-10-5-6-11-18(17)23-21/h2-13,15H,14H2,1H3
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n/an/a 64n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50378841
PNG
(CHEMBL1258387)
Show SMILES Cc1ccsc1CN=Nc1nc2ccccc2nc1Cc1ccccc1 |w:8.9|
Show InChI InChI=1S/C21H18N4S/c1-15-11-12-26-20(15)14-22-25-21-19(13-16-7-3-2-4-8-16)23-17-9-5-6-10-18(17)24-21/h2-12H,13-14H2,1H3
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n/an/a 74n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50327215
PNG
(3-Benzyl-2-(2-(4-chlorobenzylidene)hydrazinyl)quin...)
Show SMILES Clc1ccc(CN=Nc2nc3ccccc3nc2Cc2ccccc2)cc1 |w:7.7|
Show InChI InChI=1S/C22H17ClN4/c23-18-12-10-17(11-13-18)15-24-27-22-21(14-16-6-2-1-3-7-16)25-19-8-4-5-9-20(19)26-22/h1-13H,14-15H2
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n/an/a 76n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50378832
PNG
(CHEMBL1257693)
Show SMILES CC(N=Nc1nc2ccccc2nc1Cc1ccccc1)c1ccccc1 |w:3.3|
Show InChI InChI=1S/C23H20N4/c1-17(19-12-6-3-7-13-19)26-27-23-22(16-18-10-4-2-5-11-18)24-20-14-8-9-15-21(20)25-23/h2-15,17H,16H2,1H3
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n/an/a 79n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50378853
PNG
(CHEMBL1257452)
Show SMILES C(N=Nc1nc2ccccc2nc1Cc1ccccc1)c1ccccc1 |w:2.2|
Show InChI InChI=1S/C22H18N4/c1-3-9-17(10-4-1)15-21-22(25-20-14-8-7-13-19(20)24-21)26-23-16-18-11-5-2-6-12-18/h1-14H,15-16H2
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n/an/a 81n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50378843
PNG
(CHEMBL1258388)
Show SMILES C(c1ccccc1)c1nc2ccccc2n2c(nnc12)-c1ccccc1
Show InChI InChI=1S/C22H16N4/c1-3-9-16(10-4-1)15-19-22-25-24-21(17-11-5-2-6-12-17)26(22)20-14-8-7-13-18(20)23-19/h1-14H,15H2
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n/an/a 82n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50378849
PNG
(CHEMBL1257219)
Show SMILES COc1ccccc1CN=Nc1nc2ccccc2nc1Cc1ccccc1 |w:10.11|
Show InChI InChI=1S/C23H20N4O/c1-28-22-14-8-5-11-18(22)16-24-27-23-21(15-17-9-3-2-4-10-17)25-19-12-6-7-13-20(19)26-23/h2-14H,15-16H2,1H3
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n/an/a 83n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50378835
PNG
(CHEMBL1257933)
Show SMILES CN(C)c1ccc(CN=Nc2nc3ccccc3nc2Cc2ccccc2)cc1 |w:9.9|
Show InChI InChI=1S/C24H23N5/c1-29(2)20-14-12-19(13-15-20)17-25-28-24-23(16-18-8-4-3-5-9-18)26-21-10-6-7-11-22(21)27-24/h3-15H,16-17H2,1-2H3
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n/an/a 83n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50378842
PNG
(CHEMBL1256152)
Show SMILES CN=Nc1nc2ccccc2nc1Cc1ccccc1 |w:1.0|
Show InChI InChI=1S/C16H14N4/c1-17-20-16-15(11-12-7-3-2-4-8-12)18-13-9-5-6-10-14(13)19-16/h2-10H,11H2,1H3
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n/an/a 86n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50378838
PNG
(CHEMBL1258159)
Show SMILES CC(N=Nc1nc2ccccc2nc1Cc1ccccc1)c1ccc(C)cc1 |w:3.3|
Show InChI InChI=1S/C24H22N4/c1-17-12-14-20(15-13-17)18(2)27-28-24-23(16-19-8-4-3-5-9-19)25-21-10-6-7-11-22(21)26-24/h3-15,18H,16H2,1-2H3
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n/an/a 86n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50327224
PNG
(4-Benzyl-[1,2,4]triazolo[4,3-a]quinoxaline | CHEMB...)
Show SMILES C(c1ccccc1)c1nc2ccccc2n2cnnc12
Show InChI InChI=1S/C16H12N4/c1-2-6-12(7-3-1)10-14-16-19-17-11-20(16)15-9-5-4-8-13(15)18-14/h1-9,11H,10H2
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n/an/a 87n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50378845
PNG
(CHEMBL1258499)
Show SMILES Clc1ccccc1-c1nnc2c(nc3ccccc3n12)C(=O)c1ccccc1
Show InChI InChI=1S/C22H13ClN4O/c23-16-11-5-4-10-15(16)21-25-26-22-19(20(28)14-8-2-1-3-9-14)24-17-12-6-7-13-18(17)27(21)22/h1-13H
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n/an/a 88n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50378852
PNG
(CHEMBL1257451)
Show SMILES COc1ccc(cc1)C(C)N=Nc1nc2ccccc2nc1Cc1ccccc1 |w:11.12|
Show InChI InChI=1S/C24H22N4O/c1-17(19-12-14-20(29-2)15-13-19)27-28-24-23(16-18-8-4-3-5-9-18)25-21-10-6-7-11-22(21)26-24/h3-15,17H,16H2,1-2H3
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n/an/a 89n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50378836
PNG
(CHEMBL1258041)
Show SMILES CC(N=Nc1nc2ccccc2nc1Cc1ccccc1)c1ccccn1 |w:3.3|
Show InChI InChI=1S/C22H19N5/c1-16(18-11-7-8-14-23-18)26-27-22-21(15-17-9-3-2-4-10-17)24-19-12-5-6-13-20(19)25-22/h2-14,16H,15H2,1H3
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n/an/a 91n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50327218
PNG
(3-Benzyl-2-(2-(1-(4-nitrophenyl)ethylidene)hydrazi...)
Show SMILES CC(N=Nc1nc2ccccc2nc1Cc1ccccc1)c1ccc(cc1)[N+]([O-])=O |w:3.3|
Show InChI InChI=1S/C23H19N5O2/c1-16(18-11-13-19(14-12-18)28(29)30)26-27-23-22(15-17-7-3-2-4-8-17)24-20-9-5-6-10-21(20)25-23/h2-14,16H,15H2,1H3
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n/an/a 680n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))		BDBM50378848
PNG
(CHEMBL1258719)
Show SMILES O=C(c1ccccc1)c1nc2ccccc2n2cnnc12
Show InChI InChI=1S/C16H10N4O/c21-15(11-6-2-1-3-7-11)14-16-19-17-10-20(16)13-9-5-4-8-12(13)18-14/h1-10H
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n/an/a 750n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOA by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50327219
PNG
(3-Benzyl-2-(2-(3-bromobenzylidene)hydrazinyl)quino...)
Show SMILES Brc1cccc(CN=Nc2nc3ccccc3nc2Cc2ccccc2)c1 |w:8.8|
Show InChI InChI=1S/C22H17BrN4/c23-18-10-6-9-17(13-18)15-24-27-22-21(14-16-7-2-1-3-8-16)25-19-11-4-5-12-20(19)26-22/h1-13H,14-15H2
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n/an/a 4.80E+4n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50327220
PNG
(4-Benzyl-1-(2-chlorophenyl)-[1,2,4]triazolo[4,3-a]...)
Show SMILES Clc1ccccc1-c1nnc2c(Cc3ccccc3)nc3ccccc3n12
Show InChI InChI=1S/C22H15ClN4/c23-17-11-5-4-10-16(17)21-25-26-22-19(14-15-8-2-1-3-9-15)24-18-12-6-7-13-20(18)27(21)22/h1-13H,14H2
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n/an/a 7.20E+4n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50327223
PNG
(4-Benzoyl-1-(3-bromo-4-(N,N-dimethylaminophenyl))-...)
Show SMILES CN(C)c1ccc(cc1Br)-c1nnc2c(nc3ccccc3n12)C(=O)c1ccccc1
Show InChI InChI=1S/C24H18BrN5O/c1-29(2)19-13-12-16(14-17(19)25)23-27-28-24-21(22(31)15-8-4-3-5-9-15)26-18-10-6-7-11-20(18)30(23)24/h3-14H,1-2H3
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n/an/a 7.30E+4n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50327217
PNG
(3-Benzyl-2-(2-(4-methoxybenzylidene)hydrazinyl)qui...)
Show SMILES COc1ccc(CN=Nc2nc3ccccc3nc2Cc2ccccc2)cc1 |w:8.8|
Show InChI InChI=1S/C23H20N4O/c1-28-19-13-11-18(12-14-19)16-24-27-23-22(15-17-7-3-2-4-8-17)25-20-9-5-6-10-21(20)26-23/h2-14H,15-16H2,1H3
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n/an/a 7.90E+4n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50327215
PNG
(3-Benzyl-2-(2-(4-chlorobenzylidene)hydrazinyl)quin...)
Show SMILES Clc1ccc(CN=Nc2nc3ccccc3nc2Cc2ccccc2)cc1 |w:7.7|
Show InChI InChI=1S/C22H17ClN4/c23-18-12-10-17(11-13-18)15-24-27-22-21(14-16-6-2-1-3-7-16)25-19-8-4-5-9-20(19)26-22/h1-13H,14-15H2
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n/an/a 8.40E+4n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50327222
PNG
(4-Benzoyl-1-(4-methoxyphenyl)-[1,2,4]triazolo[4,3-...)
Show SMILES COc1ccc(cc1)-c1nnc2c(nc3ccccc3n12)C(=O)c1ccccc1
Show InChI InChI=1S/C23H16N4O2/c1-29-17-13-11-16(12-14-17)22-25-26-23-20(21(28)15-7-3-2-4-8-15)24-18-9-5-6-10-19(18)27(22)23/h2-14H,1H3
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n/an/a 8.50E+4n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50327221
PNG
(4-Benzoyl-1-(3,4-dimethoxyphenyl)-[1,2,4]triazolo[...)
Show SMILES COc1ccc(cc1OC)-c1nnc2c(nc3ccccc3n12)C(=O)c1ccccc1
Show InChI InChI=1S/C24H18N4O3/c1-30-19-13-12-16(14-20(19)31-2)23-26-27-24-21(22(29)15-8-4-3-5-9-15)25-17-10-6-7-11-18(17)28(23)24/h3-14H,1-2H3
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n/an/a 8.60E+4n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50327214
PNG
(2-(2-(Benzo[d][1,3]dioxol-5-ylmethylene)hydrazinyl...)
Show SMILES C(N=Nc1nc2ccccc2nc1Cc1ccccc1)c1ccc2OCOc2c1 |w:2.2|
Show InChI InChI=1S/C23H18N4O2/c1-2-6-16(7-3-1)12-20-23(26-19-9-5-4-8-18(19)25-20)27-24-14-17-10-11-21-22(13-17)29-15-28-21/h1-11,13H,12,14-15H2
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n/an/a 8.70E+4n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50327216
PNG
(3-Benzyl-2-(2-(2-chlorobenzylidene)hydrazinyl)quin...)
Show SMILES Clc1ccccc1CN=Nc1nc2ccccc2nc1Cc1ccccc1 |w:9.10|
Show InChI InChI=1S/C22H17ClN4/c23-18-11-5-4-10-17(18)15-24-27-22-21(14-16-8-2-1-3-9-16)25-19-12-6-7-13-20(19)26-22/h1-13H,14-15H2
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n/an/a 8.70E+4n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50327218
PNG
(3-Benzyl-2-(2-(1-(4-nitrophenyl)ethylidene)hydrazi...)
Show SMILES CC(N=Nc1nc2ccccc2nc1Cc1ccccc1)c1ccc(cc1)[N+]([O-])=O |w:3.3|
Show InChI InChI=1S/C23H19N5O2/c1-16(18-11-13-19(14-12-18)28(29)30)26-27-23-22(15-17-7-3-2-4-8-17)24-20-9-5-6-10-21(20)25-23/h2-14,16H,15H2,1H3
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n/an/a 8.90E+4n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50327224
PNG
(4-Benzyl-[1,2,4]triazolo[4,3-a]quinoxaline | CHEMB...)
Show SMILES C(c1ccccc1)c1nc2ccccc2n2cnnc12
Show InChI InChI=1S/C16H12N4/c1-2-6-12(7-3-1)10-14-16-19-17-11-20(16)15-9-5-4-8-13(15)18-14/h1-9,11H,10H2
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n/an/a 9.50E+4n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50378847
PNG
(CHEMBL1258718)
Show SMILES [O-][N+](=O)c1ccc(cc1)-c1nnc2c(nc3ccccc3n12)C(=O)c1ccccc1
Show InChI InChI=1S/C22H13N5O3/c28-20(14-6-2-1-3-7-14)19-22-25-24-21(15-10-12-16(13-11-15)27(29)30)26(22)18-9-5-4-8-17(18)23-19/h1-13H
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n/an/a 2.30E+5n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50378844
PNG
(CHEMBL1258839)
Show SMILES O=C(c1ccccc1)c1nc2ccccc2n2c(nnc12)-c1ccccc1
Show InChI InChI=1S/C22H14N4O/c27-20(15-9-3-1-4-10-15)19-22-25-24-21(16-11-5-2-6-12-16)26(22)18-14-8-7-13-17(18)23-19/h1-14H
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n/an/a 2.40E+5n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50378851
PNG
(CHEMBL1257341)
Show SMILES COc1cc(cc(OC)c1OC)C(C)N=Nc1nc2ccccc2nc1Cc1ccccc1 |w:15.16|
Show InChI InChI=1S/C26H26N4O3/c1-17(19-15-23(31-2)25(33-4)24(16-19)32-3)29-30-26-22(14-18-10-6-5-7-11-18)27-20-12-8-9-13-21(20)28-26/h5-13,15-17H,14H2,1-4H3
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n/an/a 2.60E+5n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50378852
PNG
(CHEMBL1257451)
Show SMILES COc1ccc(cc1)C(C)N=Nc1nc2ccccc2nc1Cc1ccccc1 |w:11.12|
Show InChI InChI=1S/C24H22N4O/c1-17(19-12-14-20(29-2)15-13-19)27-28-24-23(16-18-8-4-3-5-9-18)25-21-10-6-7-11-22(21)26-24/h3-15,17H,16H2,1-2H3
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n/an/a 2.80E+5n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50378853
PNG
(CHEMBL1257452)
Show SMILES C(N=Nc1nc2ccccc2nc1Cc1ccccc1)c1ccccc1 |w:2.2|
Show InChI InChI=1S/C22H18N4/c1-3-9-17(10-4-1)15-21-22(25-20-14-8-7-13-19(20)24-21)26-23-16-18-11-5-2-6-12-18/h1-14H,15-16H2
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n/an/a 3.20E+5n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50378845
PNG
(CHEMBL1258499)
Show SMILES Clc1ccccc1-c1nnc2c(nc3ccccc3n12)C(=O)c1ccccc1
Show InChI InChI=1S/C22H13ClN4O/c23-16-11-5-4-10-15(16)21-25-26-22-19(20(28)14-8-2-1-3-9-14)24-17-12-6-7-13-18(17)27(21)22/h1-13H
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n/an/a 3.80E+5n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50378850
PNG
(CHEMBL1257220)
Show SMILES COc1ccc(CN=Nc2nc3ccccc3nc2Cc2ccccc2)cc1OC |w:8.8|
Show InChI InChI=1S/C24H22N4O2/c1-29-22-13-12-18(15-23(22)30-2)16-25-28-24-21(14-17-8-4-3-5-9-17)26-19-10-6-7-11-20(19)27-24/h3-13,15H,14,16H2,1-2H3
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n/an/a 4.60E+5n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50378838
PNG
(CHEMBL1258159)
Show SMILES CC(N=Nc1nc2ccccc2nc1Cc1ccccc1)c1ccc(C)cc1 |w:3.3|
Show InChI InChI=1S/C24H22N4/c1-17-12-14-20(15-13-17)18(2)27-28-24-23(16-19-8-4-3-5-9-19)25-21-10-6-7-11-22(21)26-24/h3-15,18H,16H2,1-2H3
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n/an/a 7.40E+5n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50378849
PNG
(CHEMBL1257219)
Show SMILES COc1ccccc1CN=Nc1nc2ccccc2nc1Cc1ccccc1 |w:10.11|
Show InChI InChI=1S/C23H20N4O/c1-28-22-14-8-5-11-18(22)16-24-27-23-21(15-17-9-3-2-4-10-17)25-19-12-6-7-13-20(19)26-23/h2-14H,15-16H2,1H3
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n/an/a 7.90E+5n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50378837
PNG
(CHEMBL1258042)
Show SMILES CC(N=Nc1nc2ccccc2nc1Cc1ccccc1)c1cccs1 |w:3.3|
Show InChI InChI=1S/C21H18N4S/c1-15(20-12-7-13-26-20)24-25-21-19(14-16-8-3-2-4-9-16)22-17-10-5-6-11-18(17)23-21/h2-13,15H,14H2,1H3
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n/an/a 8.50E+5n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50378839
PNG
(CHEMBL1258160)
Show SMILES CC(N=Nc1nc2ccccc2nc1Cc1ccccc1)c1ccc(N)cc1 |w:3.3|
Show InChI InChI=1S/C23H21N5/c1-16(18-11-13-19(24)14-12-18)27-28-23-22(15-17-7-3-2-4-8-17)25-20-9-5-6-10-21(20)26-23/h2-14,16H,15,24H2,1H3
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n/an/a 8.60E+5n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50378841
PNG
(CHEMBL1258387)
Show SMILES Cc1ccsc1CN=Nc1nc2ccccc2nc1Cc1ccccc1 |w:8.9|
Show InChI InChI=1S/C21H18N4S/c1-15-11-12-26-20(15)14-22-25-21-19(13-16-7-3-2-4-8-16)23-17-9-5-6-10-18(17)24-21/h2-12H,13-14H2,1H3
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n/an/a 8.60E+5n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50378835
PNG
(CHEMBL1257933)
Show SMILES CN(C)c1ccc(CN=Nc2nc3ccccc3nc2Cc2ccccc2)cc1 |w:9.9|
Show InChI InChI=1S/C24H23N5/c1-29(2)20-14-12-19(13-15-20)17-25-28-24-23(16-18-8-4-3-5-9-18)26-21-10-6-7-11-22(21)27-24/h3-15H,16-17H2,1-2H3
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n/an/a 8.80E+5n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50378848
PNG
(CHEMBL1258719)
Show SMILES O=C(c1ccccc1)c1nc2ccccc2n2cnnc12
Show InChI InChI=1S/C16H10N4O/c21-15(11-6-2-1-3-7-11)14-16-19-17-10-20(16)13-9-5-4-8-12(13)18-14/h1-10H
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n/an/a 9.40E+5n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50378842
PNG
(CHEMBL1256152)
Show SMILES CN=Nc1nc2ccccc2nc1Cc1ccccc1 |w:1.0|
Show InChI InChI=1S/C16H14N4/c1-17-20-16-15(11-12-7-3-2-4-8-12)18-13-9-5-6-10-14(13)19-16/h2-10H,11H2,1H3
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n/an/a 9.50E+5n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50378840
PNG
(CHEMBL1258274)
Show SMILES [O-][N+](=O)c1ccc(CN=Nc2nc3ccccc3nc2Cc2ccccc2)cc1 |w:9.9|
Show InChI InChI=1S/C22H17N5O2/c28-27(29)18-12-10-17(11-13-18)15-23-26-22-21(14-16-6-2-1-3-7-16)24-19-8-4-5-9-20(19)25-22/h1-13H,14-15H2
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n/an/a 9.60E+5n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50378832
PNG
(CHEMBL1257693)
Show SMILES CC(N=Nc1nc2ccccc2nc1Cc1ccccc1)c1ccccc1 |w:3.3|
Show InChI InChI=1S/C23H20N4/c1-17(19-12-6-3-7-13-19)26-27-23-22(16-18-10-4-2-5-11-18)24-20-14-8-9-15-21(20)25-23/h2-15,17H,16H2,1H3
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n/an/a 9.80E+5n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50378843
PNG
(CHEMBL1258388)
Show SMILES C(c1ccccc1)c1nc2ccccc2n2c(nnc12)-c1ccccc1
Show InChI InChI=1S/C22H16N4/c1-3-9-16(10-4-1)15-19-22-25-24-21(17-11-5-2-6-12-17)26(22)20-14-8-7-13-18(20)23-19/h1-14H,15H2
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n/an/a 9.80E+5n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50378836
PNG
(CHEMBL1258041)
Show SMILES CC(N=Nc1nc2ccccc2nc1Cc1ccccc1)c1ccccn1 |w:3.3|
Show InChI InChI=1S/C22H19N5/c1-16(18-11-7-8-14-23-18)26-27-22-21(15-17-9-3-2-4-10-17)24-19-12-5-6-13-20(19)25-22/h2-14,16H,15H2,1H3
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n/an/a 9.80E+5n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50378846
PNG
(CHEMBL1258610)
Show SMILES CN(C)c1ccc(cc1)-c1nnc2c(nc3ccccc3n12)C(=O)c1ccccc1
Show InChI InChI=1S/C24H19N5O/c1-28(2)18-14-12-17(13-15-18)23-26-27-24-21(22(30)16-8-4-3-5-9-16)25-19-10-6-7-11-20(19)29(23)24/h3-15H,1-2H3
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n/an/a 7.30E+6n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50378834
PNG
(CHEMBL1257932)
Show SMILES Oc1ccc(CN=Nc2nc3ccccc3nc2Cc2ccccc2)cc1 |w:7.7|
Show InChI InChI=1S/C22H18N4O/c27-18-12-10-17(11-13-18)15-23-26-22-21(14-16-6-2-1-3-7-16)24-19-8-4-5-9-20(19)25-22/h1-13,27H,14-15H2
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n/an/a 7.90E+6n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))		BDBM50378833
PNG
(CHEMBL1257814)
Show SMILES CC(N=Nc1nc2ccccc2nc1Cc1ccccc1)c1ccc(O)cc1 |w:3.3|
Show InChI InChI=1S/C23H20N4O/c1-16(18-11-13-19(28)14-12-18)26-27-23-22(15-17-7-3-2-4-8-17)24-20-9-5-6-10-21(20)25-23/h2-14,16,28H,15H2,1H3
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n/an/a 8.40E+6n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(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 9.40E+6n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of MAOB by spectrophotometry

Eur J Med Chem 45: 4479-89 (2010)


Article DOI: 10.1016/j.ejmech.2010.07.008
BindingDB Entry DOI: 10.7270/Q21G0N86
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%