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Compile Data Set for Download or QSAR

Found 114 hits with Last Name = 'abdel-rahman' and Initial = 'h'   
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
Beta-secretase 1


(Homo sapiens (Human))
BDBM50182869
PNG
(CHEMBL439521 | N-((S)-2-amino-3-((S)-1-((S)-1-((2S...)
Show SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CNC(=O)c1nnn[nH]1)C(C)C)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)C(=O)Nc1cc(cc(c1)-c1nnn[nH]1)-c1nnn[nH]1
Show InChI InChI=1S/C34H44N18O6/c1-16(2)10-24(39-32(56)25(17(3)4)40-30(54)22(35)15-36-34(58)29-45-51-52-46-29)31(55)38-23(11-18-8-6-5-7-9-18)26(53)33(57)37-21-13-19(27-41-47-48-42-27)12-20(14-21)28-43-49-50-44-28/h5-9,12-14,16-17,22-26,53H,10-11,15,35H2,1-4H3,(H,36,58)(H,37,57)(H,38,55)(H,39,56)(H,40,54)(H,41,42,47,48)(H,43,44,49,50)(H,45,46,51,52)/t22-,23-,24-,25-,26+/m0/s1
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n/an/a 1.20n/an/an/an/an/an/a



Kyoto Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of BACE1


Bioorg Med Chem Lett 16: 2380-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.01.108
BindingDB Entry DOI: 10.7270/Q2TD9WXG
More data for this
Ligand-Target Pair
Monoamine oxidase B


(Bos taurus)
BDBM50093778
PNG
(CHEMBL3585828)
Show SMILES NNC(=O)C(Cc1ccccc1)N1C(Nc2ccccc2C1=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C15H21N6O9P/c16-6(1-2-8(22)23)15(26)30-31(27,28)3-7-10(24)11(25)14(29-7)21-5-20-9-12(17)18-4-19-13(9)21/h4-7,10-11,14,24-25H,1-3,16H2,(H,22,23)(H,27,28)(H2,17,18,19)/t6?,7-,10?,11?,14?/m0/s1
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n/an/a 1.20n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-A using serotonin substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Beta-secretase 1


(Homo sapiens (Human))
BDBM50182869
PNG
(CHEMBL439521 | N-((S)-2-amino-3-((S)-1-((S)-1-((2S...)
Show SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CNC(=O)c1nnn[nH]1)C(C)C)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)C(=O)Nc1cc(cc(c1)-c1nnn[nH]1)-c1nnn[nH]1
Show InChI InChI=1S/C34H44N18O6/c1-16(2)10-24(39-32(56)25(17(3)4)40-30(54)22(35)15-36-34(58)29-45-51-52-46-29)31(55)38-23(11-18-8-6-5-7-9-18)26(53)33(57)37-21-13-19(27-41-47-48-42-27)12-20(14-21)28-43-49-50-44-28/h5-9,12-14,16-17,22-26,53H,10-11,15,35H2,1-4H3,(H,36,58)(H,37,57)(H,38,55)(H,39,56)(H,40,54)(H,41,42,47,48)(H,43,44,49,50)(H,45,46,51,52)/t22-,23-,24-,25-,26+/m0/s1
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n/an/a 1.20n/an/an/an/an/an/a



Kyoto Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of BACE1


Bioorg Med Chem Lett 18: 1649-53 (2008)


Article DOI: 10.1016/j.bmcl.2008.01.058
BindingDB Entry DOI: 10.7270/Q2PV6M6V
More data for this
Ligand-Target Pair
Monoamine oxidase A


(Bos taurus)
BDBM50093711
PNG
(CHEMBL3585838)
Show SMILES NNC(=O)CCN1C(Nc2ccccc2C1=O)c1ccccc1
Show InChI InChI=1S/C17H18N4O2/c18-20-15(22)10-11-21-16(12-6-2-1-3-7-12)19-14-9-5-4-8-13(14)17(21)23/h1-9,16,19H,10-11,18H2,(H,20,22)
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n/an/a 1.60n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-A using serotonin substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase B


(Bos taurus)
BDBM50093757
PNG
(CHEMBL3585830)
Show SMILES COC(=O)CCN1C(Nc2ccccc2C1=O)c1ccc2OCOc2c1
Show InChI InChI=1S/C16H17F2N/c1-11(19)8-16(12-4-2-6-14(17)9-12)13-5-3-7-15(18)10-13/h2-7,9-11,16H,8,19H2,1H3/t11-/m1/s1
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n/an/a 1.70n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-A using serotonin substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase A


(Bos taurus)
BDBM50093778
PNG
(CHEMBL3585828)
Show SMILES NNC(=O)C(Cc1ccccc1)N1C(Nc2ccccc2C1=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C15H21N6O9P/c16-6(1-2-8(22)23)15(26)30-31(27,28)3-7-10(24)11(25)14(29-7)21-5-20-9-12(17)18-4-19-13(9)21/h4-7,10-11,14,24-25H,1-3,16H2,(H,22,23)(H,27,28)(H2,17,18,19)/t6?,7-,10?,11?,14?/m0/s1
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n/an/a 1.80n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-A using serotonin substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase A


(Bos taurus)
BDBM50097456
PNG
(CHEMBL3585822)
Show SMILES NNC(=O)CN1C(Nc2ccccc2C1=O)c1ccc2OCOc2c1
Show InChI InChI=1S/C17H16N4O4/c18-20-15(22)8-21-16(10-5-6-13-14(7-10)25-9-24-13)19-12-4-2-1-3-11(12)17(21)23/h1-7,16,19H,8-9,18H2,(H,20,22)
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n/an/a 2.10n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-A using serotonin substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase B


(Bos taurus)
BDBM50093711
PNG
(CHEMBL3585838)
Show SMILES NNC(=O)CCN1C(Nc2ccccc2C1=O)c1ccccc1
Show InChI InChI=1S/C17H18N4O2/c18-20-15(22)10-11-21-16(12-6-2-1-3-7-12)19-14-9-5-4-8-13(14)17(21)23/h1-9,16,19H,10-11,18H2,(H,20,22)
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n/an/a 2.10n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-B using benzylamine substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase B


(Bos taurus)
BDBM50093779
PNG
(CHEMBL3585827)
Show SMILES NNC(=O)C(Cc1ccccc1)N1C(Nc2ccccc2C1=O)c1ccco1
Show InChI InChI=1S/C21H20N4O3/c22-24-20(26)17(13-14-7-2-1-3-8-14)25-19(18-11-6-12-28-18)23-16-10-5-4-9-15(16)21(25)27/h1-12,17,19,23H,13,22H2,(H,24,26)
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n/an/a 2.20n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-A using serotonin substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase B


(Bos taurus)
BDBM50093694
PNG
(CHEMBL3585843)
Show SMILES NNC(=O)CCCN1C(Nc2ccccc2C1=O)c1ccco1
Show InChI InChI=1S/C18H19ClN4/c1-12-20-16-11-15(13-5-7-14(19)8-6-13)22-17(16)18(21-12)23-9-3-2-4-10-23/h5-8,11,22H,2-4,9-10H2,1H3
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n/an/a 2.70n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-B using benzylamine substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase A


(Bos taurus)
BDBM50097459
PNG
(CHEMBL3585817)
Show SMILES COC(=O)C(C)N1C(Nc2ccccc2C1=O)c1ccc2OCOc2c1
Show InChI InChI=1S/C19H18N2O5/c1-11(19(23)24-2)21-17(12-7-8-15-16(9-12)26-10-25-15)20-14-6-4-3-5-13(14)18(21)22/h3-9,11,17,20H,10H2,1-2H3
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n/an/a 2.80n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-A using serotonin substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase A


(Bos taurus)
BDBM50093779
PNG
(CHEMBL3585827)
Show SMILES NNC(=O)C(Cc1ccccc1)N1C(Nc2ccccc2C1=O)c1ccco1
Show InChI InChI=1S/C21H20N4O3/c22-24-20(26)17(13-14-7-2-1-3-8-14)25-19(18-11-6-12-28-18)23-16-10-5-4-9-15(16)21(25)27/h1-12,17,19,23H,13,22H2,(H,24,26)
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n/an/a 2.80n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-A using serotonin substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase A


(Bos taurus)
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 2.90n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-A using serotonin substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Monoamine oxidase B


(Bos taurus)
BDBM50093609
PNG
(CHEMBL3585836)
Show SMILES COC(=O)CCCCCN1C(Nc2ccccc2C1=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H23ClN2O3/c1-27-19(25)9-3-2-6-14-24-20(15-10-12-16(22)13-11-15)23-18-8-5-4-7-17(18)21(24)26/h4-5,7-8,10-13,20,23H,2-3,6,9,14H2,1H3
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n/an/a 2.90n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-B using benzylamine substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase B


(Bos taurus)
BDBM50097420
PNG
(CHEMBL3585826)
Show SMILES CC(N1C(Nc2ccccc2C1=O)c1ccco1)C(=O)NN
Show InChI InChI=1S/C15H16N4O3/c1-9(14(20)18-16)19-13(12-7-4-8-22-12)17-11-6-3-2-5-10(11)15(19)21/h2-9,13,17H,16H2,1H3,(H,18,20)
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n/an/a 3.10n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-B using benzylamine substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase B


(Bos taurus)
BDBM50097438
PNG
(CHEMBL3585821)
Show SMILES NNC(=O)CN1C(Nc2ccccc2C1=O)c1ccccc1
Show InChI InChI=1S/C16H16N4O2/c17-19-14(21)10-20-15(11-6-2-1-3-7-11)18-13-9-5-4-8-12(13)16(20)22/h1-9,15,18H,10,17H2,(H,19,21)
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n/an/a 3.10n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-B using benzylamine substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase A


(Bos taurus)
BDBM50093710
PNG
(CHEMBL3585839)
Show SMILES NNC(=O)CCN1C(Nc2ccccc2C1=O)c1ccc2OCOc2c1
Show InChI InChI=1S/C18H18N4O4/c19-21-16(23)7-8-22-17(11-5-6-14-15(9-11)26-10-25-14)20-13-4-2-1-3-12(13)18(22)24/h1-6,9,17,20H,7-8,10,19H2,(H,21,23)
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n/an/a 3.20n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-A using serotonin substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase A


(Bos taurus)
BDBM50097420
PNG
(CHEMBL3585826)
Show SMILES CC(N1C(Nc2ccccc2C1=O)c1ccco1)C(=O)NN
Show InChI InChI=1S/C15H16N4O3/c1-9(14(20)18-16)19-13(12-7-4-8-22-12)17-11-6-3-2-5-10(11)15(19)21/h2-9,13,17H,16H2,1H3,(H,18,20)
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n/an/a 3.20n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-A using serotonin substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Beta-secretase 1


(Homo sapiens (Human))
BDBM50188338
PNG
(CHEMBL411711 | N-((2S,5S)-5-((S)-1-((1R,2S)-1-(3-(...)
Show SMILES CC(C)[C@H](NC(=O)[C@@H](N)CNC(=O)c1nnn[nH]1)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)C(=O)Nc1cccc(c1)-c1nnn[nH]1
Show InChI InChI=1S/C36H48N14O6/c1-20(2)28(42-32(52)25(37)19-38-36(56)31-45-49-50-46-31)34(54)41-27(17-22-12-7-4-8-13-22)33(53)40-26(16-21-10-5-3-6-11-21)29(51)35(55)39-24-15-9-14-23(18-24)30-43-47-48-44-30/h3,5-6,9-11,14-15,18,20,22,25-29,51H,4,7-8,12-13,16-17,19,37H2,1-2H3,(H,38,56)(H,39,55)(H,40,53)(H,41,54)(H,42,52)(H,43,44,47,48)(H,45,46,49,50)/t25-,26-,27-,28-,29+/m0/s1
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n/an/a 3.30n/an/an/an/an/an/a



Kyoto Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of human BACE1 by FRET assay


Bioorg Med Chem 18: 3175-86 (2010)


Article DOI: 10.1016/j.bmc.2010.03.032
BindingDB Entry DOI: 10.7270/Q26M36ZV
More data for this
Ligand-Target Pair
Monoamine oxidase B


(Bos taurus)
BDBM50097461
PNG
(CHEMBL3585819)
Show SMILES COC(=O)C(Cc1ccccc1)N1C(Nc2ccccc2C1=O)c1ccco1
Show InChI InChI=1S/C22H20N2O4/c1-27-22(26)18(14-15-8-3-2-4-9-15)24-20(19-12-7-13-28-19)23-17-11-6-5-10-16(17)21(24)25/h2-13,18,20,23H,14H2,1H3
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n/an/a 3.40n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-B using benzylamine substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase A


(Bos taurus)
BDBM50097463
PNG
(CHEMBL3585814)
Show SMILES COC(=O)CN1C(Nc2ccccc2C1=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H15ClN2O3/c1-23-15(21)10-20-16(11-6-8-12(18)9-7-11)19-14-5-3-2-4-13(14)17(20)22/h2-9,16,19H,10H2,1H3
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n/an/a 3.60n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-B using benzylamine substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase A


(Bos taurus)
BDBM50093694
PNG
(CHEMBL3585843)
Show SMILES NNC(=O)CCCN1C(Nc2ccccc2C1=O)c1ccco1
Show InChI InChI=1S/C18H19ClN4/c1-12-20-16-11-15(13-5-7-14(19)8-6-13)22-17(16)18(21-12)23-9-3-2-4-10-23/h5-8,11,22H,2-4,9-10H2,1H3
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n/an/a 3.60n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-A using serotonin substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase A


(Bos taurus)
BDBM50097457
PNG
(CHEMBL3585823)
Show SMILES NNC(=O)CN1C(Nc2ccccc2C1=O)c1ccco1
Show InChI InChI=1S/C14H14N4O3/c15-17-12(19)8-18-13(11-6-3-7-21-11)16-10-5-2-1-4-9(10)14(18)20/h1-7,13,16H,8,15H2,(H,17,19)
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n/an/a 3.60n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-A using serotonin substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase B


(Bos taurus)
BDBM50093707
PNG
(CHEMBL3585841)
Show SMILES NNC(=O)CCCN1C(Nc2ccccc2C1=O)c1ccccc1
Show InChI InChI=1S/C18H19ClN4/c1-12-20-16-11-15(13-6-5-7-14(19)10-13)22-17(16)18(21-12)23-8-3-2-4-9-23/h5-7,10-11,22H,2-4,8-9H2,1H3
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n/an/a 3.70n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-B using benzylamine substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase B


(Bos taurus)
BDBM50093710
PNG
(CHEMBL3585839)
Show SMILES NNC(=O)CCN1C(Nc2ccccc2C1=O)c1ccc2OCOc2c1
Show InChI InChI=1S/C18H18N4O4/c19-21-16(23)7-8-22-17(11-5-6-14-15(9-11)26-10-25-14)20-13-4-2-1-3-12(13)18(22)24/h1-6,9,17,20H,7-8,10,19H2,(H,21,23)
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n/an/a 3.80n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-B using benzylamine substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase B


(Bos taurus)
BDBM50097469
PNG
(CHEMBL3585813)
Show SMILES COC(=O)CN1C(Nc2ccccc2C1=O)c1ccco1
Show InChI InChI=1S/C15H14N2O4/c1-20-13(18)9-17-14(12-7-4-8-21-12)16-11-6-3-2-5-10(11)15(17)19/h2-8,14,16H,9H2,1H3
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n/an/a 3.80n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-B using benzylamine substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase A


(Bos taurus)
BDBM50097438
PNG
(CHEMBL3585821)
Show SMILES NNC(=O)CN1C(Nc2ccccc2C1=O)c1ccccc1
Show InChI InChI=1S/C16H16N4O2/c17-19-14(21)10-20-15(11-6-2-1-3-7-11)18-13-9-5-4-8-12(13)16(20)22/h1-9,15,18H,10,17H2,(H,19,21)
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n/an/a 3.80n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-A using serotonin substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase A


(Bos taurus)
BDBM50097470
PNG
(CHEMBL3585807)
Show SMILES COC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1N
Show InChI InChI=1S/C17H18N2O3/c1-22-17(21)15(11-12-7-3-2-4-8-12)19-16(20)13-9-5-6-10-14(13)18/h2-10,15H,11,18H2,1H3,(H,19,20)/t15-/m0/s1
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n/an/a 3.80n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-A using serotonin substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Beta-secretase 1


(Homo sapiens (Human))
BDBM50157441
PNG
(5-((2R,3S)-3-((S)-2-((S)-2-((S)-2-amino-3-(2H-tetr...)
Show SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CNC(=O)c1nnn[nH]1)C(C)C)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)C(=O)Nc1cc(cc(c1)C(O)=O)C(O)=O
Show InChI InChI=1S/C34H44N10O10/c1-16(2)10-24(39-30(48)25(17(3)4)40-28(46)22(35)15-36-32(50)27-41-43-44-42-27)29(47)38-23(11-18-8-6-5-7-9-18)26(45)31(49)37-21-13-19(33(51)52)12-20(14-21)34(53)54/h5-9,12-14,16-17,22-26,45H,10-11,15,35H2,1-4H3,(H,36,50)(H,37,49)(H,38,47)(H,39,48)(H,40,46)(H,51,52)(H,53,54)(H,41,42,43,44)/t22-,23-,24-,25-,26+/m0/s1
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n/an/a 3.90n/an/an/an/an/an/a



Kyoto Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of BACE1


Bioorg Med Chem Lett 18: 1649-53 (2008)


Article DOI: 10.1016/j.bmcl.2008.01.058
BindingDB Entry DOI: 10.7270/Q2PV6M6V
More data for this
Ligand-Target Pair
Beta-secretase 1


(Homo sapiens (Human))
BDBM50157441
PNG
(5-((2R,3S)-3-((S)-2-((S)-2-((S)-2-amino-3-(2H-tetr...)
Show SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CNC(=O)c1nnn[nH]1)C(C)C)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)C(=O)Nc1cc(cc(c1)C(O)=O)C(O)=O
Show InChI InChI=1S/C34H44N10O10/c1-16(2)10-24(39-30(48)25(17(3)4)40-28(46)22(35)15-36-32(50)27-41-43-44-42-27)29(47)38-23(11-18-8-6-5-7-9-18)26(45)31(49)37-21-13-19(33(51)52)12-20(14-21)34(53)54/h5-9,12-14,16-17,22-26,45H,10-11,15,35H2,1-4H3,(H,36,50)(H,37,49)(H,38,47)(H,39,48)(H,40,46)(H,51,52)(H,53,54)(H,41,42,43,44)/t22-,23-,24-,25-,26+/m0/s1
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n/an/a 3.90n/an/an/an/an/an/a



Kyoto Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of BACE1


Bioorg Med Chem Lett 16: 2380-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.01.108
BindingDB Entry DOI: 10.7270/Q2TD9WXG
More data for this
Ligand-Target Pair
Monoamine oxidase A


(Bos taurus)
BDBM50097465
PNG
(CHEMBL3585816)
Show SMILES COC(=O)C(C)N1C(Nc2ccccc2C1=O)c1ccccc1
Show InChI InChI=1S/C18H18N2O3/c1-12(18(22)23-2)20-16(13-8-4-3-5-9-13)19-15-11-7-6-10-14(15)17(20)21/h3-12,16,19H,1-2H3
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n/an/a 3.90n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-B using benzylamine substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase B


(Bos taurus)
BDBM50093642
PNG
(CHEMBL3278797)
Show SMILES COC(=O)[C@H](C)NC(=O)c1ccccc1N
Show InChI InChI=1S/C18H17F3N4/c1-10-22-15-9-14(11-7-12(19)16(21)13(20)8-11)24-17(15)18(23-10)25-5-3-2-4-6-25/h7-9,24H,2-6H2,1H3
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n/an/a 4.10n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-B using benzylamine substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase B


(Bos taurus)
BDBM50093703
PNG
(CHEMBL3585842)
Show SMILES NNC(=O)CCCN1C(Nc2ccccc2C1=O)c1ccc2OCOc2c1
Show InChI InChI=1S/C19H19F3N4/c1-12-23-16-11-15(13-6-5-7-14(10-13)19(20,21)22)25-17(16)18(24-12)26-8-3-2-4-9-26/h5-7,10-11,25H,2-4,8-9H2,1H3
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n/an/a 4.20n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-B using benzylamine substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase B


(Bos taurus)
BDBM50093709
PNG
(CHEMBL3585840)
Show SMILES NNC(=O)CCN1C(Nc2ccccc2C1=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H17ClN4O2/c18-12-7-5-11(6-8-12)16-20-14-4-2-1-3-13(14)17(24)22(16)10-9-15(23)21-19/h1-8,16,20H,9-10,19H2,(H,21,23)
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n/an/a 4.20n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-B using benzylamine substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase A


(Bos taurus)
BDBM50097462
PNG
(CHEMBL3585820)
Show SMILES COC(=O)C(Cc1ccccc1)N1C(Nc2ccccc2C1=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C24H21ClN2O3/c1-30-24(29)21(15-16-7-3-2-4-8-16)27-22(17-11-13-18(25)14-12-17)26-20-10-6-5-9-19(20)23(27)28/h2-14,21-22,26H,15H2,1H3
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n/an/a 4.20n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-A using serotonin substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase A


(Bos taurus)
BDBM50093609
PNG
(CHEMBL3585836)
Show SMILES COC(=O)CCCCCN1C(Nc2ccccc2C1=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H23ClN2O3/c1-27-19(25)9-3-2-6-14-24-20(15-10-12-16(22)13-11-15)23-18-8-5-4-7-17(18)21(24)26/h4-5,7-8,10-13,20,23H,2-3,6,9,14H2,1H3
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n/an/a 4.40n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-A using serotonin substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase A


(Bos taurus)
BDBM50097469
PNG
(CHEMBL3585813)
Show SMILES COC(=O)CN1C(Nc2ccccc2C1=O)c1ccco1
Show InChI InChI=1S/C15H14N2O4/c1-20-13(18)9-17-14(12-7-4-8-21-12)16-11-6-3-2-5-10(11)15(17)19/h2-8,14,16H,9H2,1H3
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n/an/a 4.40n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-A using serotonin substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase B


(Bos taurus)
BDBM50097466
PNG
(CHEMBL3585810)
Show SMILES COC(=O)CCCCCNC(=O)c1ccccc1N
Show InChI InChI=1S/C14H20N2O3/c1-19-13(17)9-3-2-6-10-16-14(18)11-7-4-5-8-12(11)15/h4-5,7-8H,2-3,6,9-10,15H2,1H3,(H,16,18)
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n/an/a 4.40n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-B using benzylamine substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase B


(Bos taurus)
BDBM50097465
PNG
(CHEMBL3585816)
Show SMILES COC(=O)C(C)N1C(Nc2ccccc2C1=O)c1ccccc1
Show InChI InChI=1S/C18H18N2O3/c1-12(18(22)23-2)20-16(13-8-4-3-5-9-13)19-15-11-7-6-10-14(15)17(20)21/h3-12,16,19H,1-2H3
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n/an/a 4.60n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-B using benzylamine substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase B


(Bos taurus)
BDBM50097472
PNG
(CHEMBL3585809)
Show SMILES COC(=O)CCCNC(=O)c1ccccc1N
Show InChI InChI=1S/C12H16N2O3/c1-17-11(15)7-4-8-14-12(16)9-5-2-3-6-10(9)13/h2-3,5-6H,4,7-8,13H2,1H3,(H,14,16)
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n/an/a 4.60n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-B using benzylamine substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase A


(Bos taurus)
BDBM50093707
PNG
(CHEMBL3585841)
Show SMILES NNC(=O)CCCN1C(Nc2ccccc2C1=O)c1ccccc1
Show InChI InChI=1S/C18H19ClN4/c1-12-20-16-11-15(13-6-5-7-14(19)10-13)22-17(16)18(21-12)23-8-3-2-4-9-23/h5-7,10-11,22H,2-4,8-9H2,1H3
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n/an/a 4.70n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-A using serotonin substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Beta-secretase 1


(Homo sapiens (Human))
BDBM50182871
PNG
(CHEMBL381826 | N-((2S,5S)-5-((S)-1-((1R,2S)-1-(3-(...)
Show SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CNC(=O)c1nnn[nH]1)C(C)C)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)C(=O)Nc1cccc(c1)-c1nnn[nH]1
Show InChI InChI=1S/C33H44N14O6/c1-17(2)13-24(38-31(51)25(18(3)4)39-29(49)22(34)16-35-33(53)28-42-46-47-43-28)30(50)37-23(14-19-9-6-5-7-10-19)26(48)32(52)36-21-12-8-11-20(15-21)27-40-44-45-41-27/h5-12,15,17-18,22-26,48H,13-14,16,34H2,1-4H3,(H,35,53)(H,36,52)(H,37,50)(H,38,51)(H,39,49)(H,40,41,44,45)(H,42,43,46,47)/t22-,23-,24-,25-,26+/m0/s1
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n/an/a 4.80n/an/an/an/an/an/a



Kyoto Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of BACE1


Bioorg Med Chem Lett 16: 2380-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.01.108
BindingDB Entry DOI: 10.7270/Q2TD9WXG
More data for this
Ligand-Target Pair
Monoamine oxidase A


(Bos taurus)
BDBM50097458
PNG
(CHEMBL3585824)
Show SMILES NNC(=O)CN1C(Nc2ccccc2C1=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C16H15ClN4O2/c17-11-7-5-10(6-8-11)15-19-13-4-2-1-3-12(13)16(23)21(15)9-14(22)20-18/h1-8,15,19H,9,18H2,(H,20,22)
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n/an/a 4.80n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-A using serotonin substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase A


(Bos taurus)
BDBM50097464
PNG
(CHEMBL3585815)
Show SMILES COC(=O)CN1C(Nc2ccccc2C1=O)c1ccc(OC)cc1
Show InChI InChI=1S/C18H18N2O4/c1-23-13-9-7-12(8-10-13)17-19-15-6-4-3-5-14(15)18(22)20(17)11-16(21)24-2/h3-10,17,19H,11H2,1-2H3
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n/an/a 4.80n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-B using benzylamine substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Beta-secretase 1


(Homo sapiens (Human))
BDBM50182871
PNG
(CHEMBL381826 | N-((2S,5S)-5-((S)-1-((1R,2S)-1-(3-(...)
Show SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CNC(=O)c1nnn[nH]1)C(C)C)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)C(=O)Nc1cccc(c1)-c1nnn[nH]1
Show InChI InChI=1S/C33H44N14O6/c1-17(2)13-24(38-31(51)25(18(3)4)39-29(49)22(34)16-35-33(53)28-42-46-47-43-28)30(50)37-23(14-19-9-6-5-7-10-19)26(48)32(52)36-21-12-8-11-20(15-21)27-40-44-45-41-27/h5-12,15,17-18,22-26,48H,13-14,16,34H2,1-4H3,(H,35,53)(H,36,52)(H,37,50)(H,38,51)(H,39,49)(H,40,41,44,45)(H,42,43,46,47)/t22-,23-,24-,25-,26+/m0/s1
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n/an/a 4.80n/an/an/an/an/an/a



Kyoto Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of human BACE1 by FRET assay


Bioorg Med Chem 18: 3175-86 (2010)


Article DOI: 10.1016/j.bmc.2010.03.032
BindingDB Entry DOI: 10.7270/Q26M36ZV
More data for this
Ligand-Target Pair
Monoamine oxidase A


(Bos taurus)
BDBM50093709
PNG
(CHEMBL3585840)
Show SMILES NNC(=O)CCN1C(Nc2ccccc2C1=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H17ClN4O2/c18-12-7-5-11(6-8-12)16-20-14-4-2-1-3-13(14)17(24)22(16)10-9-15(23)21-19/h1-8,16,20H,9-10,19H2,(H,21,23)
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n/an/a 5.10n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-A using serotonin substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase A


(Bos taurus)
BDBM50093668
PNG
(CHEMBL3585806)
Show SMILES COC(=O)CNC(=O)c1ccccc1N
Show InChI InChI=1S/C18H18F2N4/c1-11-21-16-10-15(12-5-6-13(19)14(20)9-12)23-17(16)18(22-11)24-7-3-2-4-8-24/h5-6,9-10,23H,2-4,7-8H2,1H3
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n/an/a 5.20n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-A using serotonin substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase B


(Bos taurus)
BDBM50097462
PNG
(CHEMBL3585820)
Show SMILES COC(=O)C(Cc1ccccc1)N1C(Nc2ccccc2C1=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C24H21ClN2O3/c1-30-24(29)21(15-16-7-3-2-4-8-16)27-22(17-11-13-18(25)14-12-17)26-20-10-6-5-9-19(20)23(27)28/h2-14,21-22,26H,15H2,1H3
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n/an/a 5.40n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-B using benzylamine substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase B


(Bos taurus)
BDBM50093715
PNG
(CHEMBL3585832)
Show SMILES COC(=O)CCCN1C(Nc2ccccc2C1=O)c1ccccc1
Show InChI InChI=1S/C19H20N2O3/c1-24-17(22)12-7-13-21-18(14-8-3-2-4-9-14)20-16-11-6-5-10-15(16)19(21)23/h2-6,8-11,18,20H,7,12-13H2,1H3
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n/an/a 5.40n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-A using serotonin substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
Monoamine oxidase B


(Bos taurus)
BDBM50093712
PNG
(CHEMBL3585837)
Show SMILES COC(=O)CCCCCNC(=O)c1ccccc1\N=C\c1ccccc1
Show InChI InChI=1S/C21H24N2O3/c1-26-20(24)14-6-3-9-15-22-21(25)18-12-7-8-13-19(18)23-16-17-10-4-2-5-11-17/h2,4-5,7-8,10-13,16H,3,6,9,14-15H2,1H3,(H,22,25)/b23-16+
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n/an/a 5.40n/an/an/an/an/an/a



Alexandria University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain mitochondria MAO-B using benzylamine substrate after 60 mins by fluorimetric method


Bioorg Med Chem 23: 3574-85 (2015)


Article DOI: 10.1016/j.bmc.2015.04.021
BindingDB Entry DOI: 10.7270/Q28K7BVZ
More data for this
Ligand-Target Pair
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