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21 similar compounds to monomer 50127231

Compile data set for download or QSAR
Wt: 482.5
BDBM50127230
Wt: 482.5
BDBM50127229
Wt: 502.9
BDBM50127235
Wt: 538.5
BDBM50127234
Wt: 547.3
BDBM50127240
Wt: 547.3
BDBM50127241
Wt: 502.9
BDBM50127237
Wt: 511.5
BDBM50127238
Wt: 512.5
BDBM50127242
Wt: 498.5
BDBM50127244
Wt: 330.8
BDBM50127245
Wt: 577.4
BDBM50127233
Wt: 528.5
BDBM50127232
Wt: 486.4
BDBM50127236
Wt: 468.4
BDBM50127243
Displayed 1 to 15 (of 21 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 31 hits for monomerid = 50127230,50127229,50127235,50127234,50127240,50127241,50127237,50127238,50127242,50127244,50127245,50127233,50127232,50127236,50127243   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Histamine H4 receptor


(Homo sapiens (Human))
BDBM50127245
PNG
(CHEMBL3628042)
Show SMILES CN1CCN(CC1)c1nc(N)nc(\C=C\c2cccc(Cl)c2)n1
Show InChI InChI=1S/C16H19ClN6/c1-22-7-9-23(10-8-22)16-20-14(19-15(18)21-16)6-5-12-3-2-4-13(17)11-12/h2-6,11H,7-10H2,1H3,(H2,18,19,20,21)/b6-5+
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253n/an/an/an/an/an/an/an/a



Jagiellonian University Medical College

Curated by ChEMBL


Assay Description
Displacement of [3H]histamine from human H4 receptor expressed in Sf9 cell membranes co-expressing Galphai2 and Gbeta1gamma2 after 60 mins by liquid ...


Eur J Med Chem 103: 238-51 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.014
BindingDB Entry DOI: 10.7270/Q25M67JQ
More data for this
Ligand-Target Pair
Histamine H4 Receptor


(Mus musculus (mouse))
BDBM50127245
PNG
(CHEMBL3628042)
Show SMILES CN1CCN(CC1)c1nc(N)nc(\C=C\c2cccc(Cl)c2)n1
Show InChI InChI=1S/C16H19ClN6/c1-22-7-9-23(10-8-22)16-20-14(19-15(18)21-16)6-5-12-3-2-4-13(17)11-12/h2-6,11H,7-10H2,1H3,(H2,18,19,20,21)/b6-5+
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854n/an/an/an/an/an/an/an/a



Jagiellonian University Medical College

Curated by ChEMBL


Assay Description
Displacement of [3H]histamine from mouse H4 receptor expressed in HEK293 cell membranes co-expressing Galphai2 and Gbeta1gamma2 after 1 hr by liquid ...


Eur J Med Chem 103: 238-51 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.014
BindingDB Entry DOI: 10.7270/Q25M67JQ
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50127232
PNG
(CHEMBL3629811)
Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)c2cc3c(OC)cc(OC)cc3oc2=O)cc1
Show InChI InChI=1S/C31H28O8/c1-34-21-10-7-19(8-11-21)6-9-20-14-22(35-2)15-28(37-4)24(20)12-13-27(32)25-18-26-29(38-5)16-23(36-3)17-30(26)39-31(25)33/h6-18H,1-5H3/b9-6+,13-12+
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n/an/a 2.12E+4n/an/an/an/an/an/a



Hefei University of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOA using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate additio...


Eur J Med Chem 103: 185-90 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.055
BindingDB Entry DOI: 10.7270/Q29C7070
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50127233
PNG
(CHEMBL3629812)
Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)c2cc3cc(Br)cc(OC)c3oc2=O)cc1
Show InChI InChI=1S/C30H25BrO7/c1-34-22-9-6-18(7-10-22)5-8-19-14-23(35-2)17-27(36-3)24(19)11-12-26(32)25-15-20-13-21(31)16-28(37-4)29(20)38-30(25)33/h5-17H,1-4H3/b8-5+,12-11+
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n/an/a>6.00E+4n/an/an/an/an/an/a



Hefei University of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOA using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate additio...


Eur J Med Chem 103: 185-90 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.055
BindingDB Entry DOI: 10.7270/Q29C7070
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50127234
PNG
(CHEMBL3629813)
Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)c2cc3cc(CC=C)cc(OC)c3oc2=O)cc1
Show InChI InChI=1S/C33H30O7/c1-6-7-22-16-24-19-28(33(35)40-32(24)31(17-22)39-5)29(34)15-14-27-23(18-26(37-3)20-30(27)38-4)11-8-21-9-12-25(36-2)13-10-21/h6,8-20H,1,7H2,2-5H3/b11-8+,15-14+
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n/an/a 5.30E+3n/an/an/an/an/an/a



Hefei University of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOA using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate additio...


Eur J Med Chem 103: 185-90 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.055
BindingDB Entry DOI: 10.7270/Q29C7070
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50127230
PNG
(CHEMBL3629473)
Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)c2cc3cc(C)ccc3oc2=O)cc1
Show InChI InChI=1S/C30H26O6/c1-19-5-14-28-22(15-19)17-26(30(32)36-28)27(31)13-12-25-21(16-24(34-3)18-29(25)35-4)9-6-20-7-10-23(33-2)11-8-20/h5-18H,1-4H3/b9-6+,13-12+
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n/an/a 5.09E+3n/an/an/an/an/an/a



Hefei University of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOB using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate additio...


Eur J Med Chem 103: 185-90 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.055
BindingDB Entry DOI: 10.7270/Q29C7070
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50127235
PNG
(CHEMBL3629475)
Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)c2cc3ccc(Cl)cc3oc2=O)cc1
Show InChI InChI=1S/C29H23ClO6/c1-33-22-10-5-18(6-11-22)4-7-19-14-23(34-2)17-28(35-3)24(19)12-13-26(31)25-15-20-8-9-21(30)16-27(20)36-29(25)32/h4-17H,1-3H3/b7-4+,13-12+
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n/an/a 7.36E+3n/an/an/an/an/an/a



Hefei University of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOB using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate additio...


Eur J Med Chem 103: 185-90 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.055
BindingDB Entry DOI: 10.7270/Q29C7070
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50127236
PNG
(CHEMBL3629474)
Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)c2cc3cc(F)ccc3oc2=O)cc1
Show InChI InChI=1S/C29H23FO6/c1-33-22-9-5-18(6-10-22)4-7-19-15-23(34-2)17-28(35-3)24(19)11-12-26(31)25-16-20-14-21(30)8-13-27(20)36-29(25)32/h4-17H,1-3H3/b7-4+,12-11+
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n/an/a 1.02E+4n/an/an/an/an/an/a



Hefei University of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOB using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate additio...


Eur J Med Chem 103: 185-90 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.055
BindingDB Entry DOI: 10.7270/Q29C7070
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50127236
PNG
(CHEMBL3629474)
Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)c2cc3cc(F)ccc3oc2=O)cc1
Show InChI InChI=1S/C29H23FO6/c1-33-22-9-5-18(6-10-22)4-7-19-15-23(34-2)17-28(35-3)24(19)11-12-26(31)25-16-20-14-21(30)8-13-27(20)36-29(25)32/h4-17H,1-3H3/b7-4+,12-11+
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n/an/a 4.43E+4n/an/an/an/an/an/a



Hefei University of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOA using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate additio...


Eur J Med Chem 103: 185-90 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.055
BindingDB Entry DOI: 10.7270/Q29C7070
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50127235
PNG
(CHEMBL3629475)
Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)c2cc3ccc(Cl)cc3oc2=O)cc1
Show InChI InChI=1S/C29H23ClO6/c1-33-22-10-5-18(6-11-22)4-7-19-14-23(34-2)17-28(35-3)24(19)12-13-26(31)25-15-20-8-9-21(30)16-27(20)36-29(25)32/h4-17H,1-3H3/b7-4+,13-12+
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n/an/a>6.00E+4n/an/an/an/an/an/a



Hefei University of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOA using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate additio...


Eur J Med Chem 103: 185-90 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.055
BindingDB Entry DOI: 10.7270/Q29C7070
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50127237
PNG
(CHEMBL3629805)
Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)c2cc3cc(Cl)ccc3oc2=O)cc1
Show InChI InChI=1S/C29H23ClO6/c1-33-22-9-5-18(6-10-22)4-7-19-15-23(34-2)17-28(35-3)24(19)11-12-26(31)25-16-20-14-21(30)8-13-27(20)36-29(25)32/h4-17H,1-3H3/b7-4+,12-11+
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n/an/a>6.00E+4n/an/an/an/an/an/a



Hefei University of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOA using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate additio...


Eur J Med Chem 103: 185-90 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.055
BindingDB Entry DOI: 10.7270/Q29C7070
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50127238
PNG
(CHEMBL3629814)
Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)c2cc3ccc(cc3oc2=O)N(C)C)cc1
Show InChI InChI=1S/C31H29NO6/c1-32(2)23-11-10-22-17-27(31(34)38-29(22)18-23)28(33)15-14-26-21(16-25(36-4)19-30(26)37-5)9-6-20-7-12-24(35-3)13-8-20/h6-19H,1-5H3/b9-6+,15-14+
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n/an/a 6.00E+4n/an/an/an/an/an/a



Hefei University of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOA using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate additio...


Eur J Med Chem 103: 185-90 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.055
BindingDB Entry DOI: 10.7270/Q29C7070
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50127240
PNG
(CHEMBL3629807)
Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)c2cc3ccc(Br)cc3oc2=O)cc1
Show InChI InChI=1S/C29H23BrO6/c1-33-22-10-5-18(6-11-22)4-7-19-14-23(34-2)17-28(35-3)24(19)12-13-26(31)25-15-20-8-9-21(30)16-27(20)36-29(25)32/h4-17H,1-3H3/b7-4+,13-12+
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n/an/a 3.01E+3n/an/an/an/an/an/a



Hefei University of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOA using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate additio...


Eur J Med Chem 103: 185-90 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.055
BindingDB Entry DOI: 10.7270/Q29C7070
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50127241
PNG
(CHEMBL3629808)
Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)c2cc3cc(Br)ccc3oc2=O)cc1
Show InChI InChI=1S/C29H23BrO6/c1-33-22-9-5-18(6-10-22)4-7-19-15-23(34-2)17-28(35-3)24(19)11-12-26(31)25-16-20-14-21(30)8-13-27(20)36-29(25)32/h4-17H,1-3H3/b7-4+,12-11+
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n/an/a 1.21E+4n/an/an/an/an/an/a



Hefei University of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOA using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate additio...


Eur J Med Chem 103: 185-90 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.055
BindingDB Entry DOI: 10.7270/Q29C7070
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50127242
PNG
(CHEMBL3629809)
Show SMILES CCOc1cccc2cc(C(=O)\C=C\c3c(OC)cc(OC)cc3\C=C\c3ccc(OC)cc3)c(=O)oc12
Show InChI InChI=1S/C31H28O7/c1-5-37-28-8-6-7-22-18-26(31(33)38-30(22)28)27(32)16-15-25-21(17-24(35-3)19-29(25)36-4)12-9-20-10-13-23(34-2)14-11-20/h6-19H,5H2,1-4H3/b12-9+,16-15+
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n/an/a 3.20E+3n/an/an/an/an/an/a



Hefei University of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOA using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate additio...


Eur J Med Chem 103: 185-90 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.055
BindingDB Entry DOI: 10.7270/Q29C7070
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50127243
PNG
(CHEMBL3629466)
Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)c2cc3ccccc3oc2=O)cc1
Show InChI InChI=1S/C29H24O6/c1-32-22-12-9-19(10-13-22)8-11-20-16-23(33-2)18-28(34-3)24(20)14-15-26(30)25-17-21-6-4-5-7-27(21)35-29(25)31/h4-18H,1-3H3/b11-8+,15-14+
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n/an/a 9.17E+3n/an/an/an/an/an/a



Hefei University of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOB using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate additio...


Eur J Med Chem 103: 185-90 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.055
BindingDB Entry DOI: 10.7270/Q29C7070
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50127244
PNG
(CHEMBL3629467)
Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)c2cc3cccc(OC)c3oc2=O)cc1
Show InChI InChI=1S/C30H26O7/c1-33-22-12-9-19(10-13-22)8-11-20-16-23(34-2)18-28(36-4)24(20)14-15-26(31)25-17-21-6-5-7-27(35-3)29(21)37-30(25)32/h5-18H,1-4H3/b11-8+,15-14+
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n/an/a 2.24E+4n/an/an/an/an/an/a



Hefei University of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOB using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate additio...


Eur J Med Chem 103: 185-90 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.055
BindingDB Entry DOI: 10.7270/Q29C7070
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50127244
PNG
(CHEMBL3629467)
Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)c2cc3cccc(OC)c3oc2=O)cc1
Show InChI InChI=1S/C30H26O7/c1-33-22-12-9-19(10-13-22)8-11-20-16-23(34-2)18-28(36-4)24(20)14-15-26(31)25-17-21-6-5-7-27(35-3)29(21)37-30(25)32/h5-18H,1-4H3/b11-8+,15-14+
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n/an/a>6.00E+4n/an/an/an/an/an/a



Hefei University of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOA using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate additio...


Eur J Med Chem 103: 185-90 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.055
BindingDB Entry DOI: 10.7270/Q29C7070
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50127243
PNG
(CHEMBL3629466)
Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)c2cc3ccccc3oc2=O)cc1
Show InChI InChI=1S/C29H24O6/c1-32-22-12-9-19(10-13-22)8-11-20-16-23(33-2)18-28(34-3)24(20)14-15-26(30)25-17-21-6-4-5-7-27(21)35-29(25)31/h4-18H,1-3H3/b11-8+,15-14+
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n/an/a 4.17E+4n/an/an/an/an/an/a



Hefei University of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOA using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate additio...


Eur J Med Chem 103: 185-90 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.055
BindingDB Entry DOI: 10.7270/Q29C7070
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50127242
PNG
(CHEMBL3629809)
Show SMILES CCOc1cccc2cc(C(=O)\C=C\c3c(OC)cc(OC)cc3\C=C\c3ccc(OC)cc3)c(=O)oc12
Show InChI InChI=1S/C31H28O7/c1-5-37-28-8-6-7-22-18-26(31(33)38-30(22)28)27(32)16-15-25-21(17-24(35-3)19-29(25)36-4)12-9-20-10-13-23(34-2)14-11-20/h6-19H,5H2,1-4H3/b12-9+,16-15+
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n/an/a>6.00E+4n/an/an/an/an/an/a



Hefei University of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOB using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate additio...


Eur J Med Chem 103: 185-90 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.055
BindingDB Entry DOI: 10.7270/Q29C7070
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50127241
PNG
(CHEMBL3629808)
Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)c2cc3cc(Br)ccc3oc2=O)cc1
Show InChI InChI=1S/C29H23BrO6/c1-33-22-9-5-18(6-10-22)4-7-19-15-23(34-2)17-28(35-3)24(19)11-12-26(31)25-16-20-14-21(30)8-13-27(20)36-29(25)32/h4-17H,1-3H3/b7-4+,12-11+
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n/an/a>6.00E+4n/an/an/an/an/an/a



Hefei University of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOB using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate additio...


Eur J Med Chem 103: 185-90 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.055
BindingDB Entry DOI: 10.7270/Q29C7070
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50127240
PNG
(CHEMBL3629807)
Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)c2cc3ccc(Br)cc3oc2=O)cc1
Show InChI InChI=1S/C29H23BrO6/c1-33-22-10-5-18(6-11-22)4-7-19-14-23(34-2)17-28(35-3)24(19)12-13-26(31)25-15-20-8-9-21(30)16-27(20)36-29(25)32/h4-17H,1-3H3/b7-4+,13-12+
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n/an/a 5.53E+4n/an/an/an/an/an/a



Hefei University of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOB using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate additio...


Eur J Med Chem 103: 185-90 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.055
BindingDB Entry DOI: 10.7270/Q29C7070
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50127237
PNG
(CHEMBL3629805)
Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)c2cc3cc(Cl)ccc3oc2=O)cc1
Show InChI InChI=1S/C29H23ClO6/c1-33-22-9-5-18(6-10-22)4-7-19-15-23(34-2)17-28(35-3)24(19)11-12-26(31)25-16-20-14-21(30)8-13-27(20)36-29(25)32/h4-17H,1-3H3/b7-4+,12-11+
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n/an/a>6.00E+4n/an/an/an/an/an/a



Hefei University of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOB using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate additio...


Eur J Med Chem 103: 185-90 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.055
BindingDB Entry DOI: 10.7270/Q29C7070
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50127232
PNG
(CHEMBL3629811)
Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)c2cc3c(OC)cc(OC)cc3oc2=O)cc1
Show InChI InChI=1S/C31H28O8/c1-34-21-10-7-19(8-11-21)6-9-20-14-22(35-2)15-28(37-4)24(20)12-13-27(32)25-18-26-29(38-5)16-23(36-3)17-30(26)39-31(25)33/h6-18H,1-5H3/b9-6+,13-12+
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n/an/a 3.55E+4n/an/an/an/an/an/a



Hefei University of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOB using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate additio...


Eur J Med Chem 103: 185-90 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.055
BindingDB Entry DOI: 10.7270/Q29C7070
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50127233
PNG
(CHEMBL3629812)
Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)c2cc3cc(Br)cc(OC)c3oc2=O)cc1
Show InChI InChI=1S/C30H25BrO7/c1-34-22-9-6-18(7-10-22)5-8-19-14-23(35-2)17-27(36-3)24(19)11-12-26(32)25-15-20-13-21(31)16-28(37-4)29(20)38-30(25)33/h5-17H,1-4H3/b8-5+,12-11+
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n/an/a>6.00E+4n/an/an/an/an/an/a



Hefei University of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOB using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate additio...


Eur J Med Chem 103: 185-90 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.055
BindingDB Entry DOI: 10.7270/Q29C7070
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50127234
PNG
(CHEMBL3629813)
Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)c2cc3cc(CC=C)cc(OC)c3oc2=O)cc1
Show InChI InChI=1S/C33H30O7/c1-6-7-22-16-24-19-28(33(35)40-32(24)31(17-22)39-5)29(34)15-14-27-23(18-26(37-3)20-30(27)38-4)11-8-21-9-12-25(36-2)13-10-21/h6,8-20H,1,7H2,2-5H3/b11-8+,15-14+
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n/an/a 5.05E+4n/an/an/an/an/an/a



Hefei University of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOB using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate additio...


Eur J Med Chem 103: 185-90 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.055
BindingDB Entry DOI: 10.7270/Q29C7070
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50127238
PNG
(CHEMBL3629814)
Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)c2cc3ccc(cc3oc2=O)N(C)C)cc1
Show InChI InChI=1S/C31H29NO6/c1-32(2)23-11-10-22-17-27(31(34)38-29(22)18-23)28(33)15-14-26-21(16-25(36-4)19-30(26)37-5)9-6-20-7-12-24(35-3)13-8-20/h6-19H,1-5H3/b9-6+,15-14+
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n/an/a>6.00E+4n/an/an/an/an/an/a



Hefei University of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOB using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate additio...


Eur J Med Chem 103: 185-90 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.055
BindingDB Entry DOI: 10.7270/Q29C7070
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM50127245
PNG
(CHEMBL3628042)
Show SMILES CN1CCN(CC1)c1nc(N)nc(\C=C\c2cccc(Cl)c2)n1
Show InChI InChI=1S/C16H19ClN6/c1-22-7-9-23(10-8-22)16-20-14(19-15(18)21-16)6-5-12-3-2-4-13(17)11-12/h2-6,11H,7-10H2,1H3,(H2,18,19,20,21)/b6-5+
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n/an/a 439n/an/an/an/an/an/a



Jagiellonian University Medical College

Curated by ChEMBL


Assay Description
Antagonist activity at human H4R expressed in CHO cells assessed as inhibition of forskolin-induced cAMP accumulation after 30 mins by TR-FRET immuno...


Eur J Med Chem 103: 238-51 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.014
BindingDB Entry DOI: 10.7270/Q25M67JQ
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50127230
PNG
(CHEMBL3629473)
Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)c2cc3cc(C)ccc3oc2=O)cc1
Show InChI InChI=1S/C30H26O6/c1-19-5-14-28-22(15-19)17-26(30(32)36-28)27(31)13-12-25-21(16-24(34-3)18-29(25)35-4)9-6-20-7-10-23(33-2)11-8-20/h5-18H,1-4H3/b9-6+,13-12+
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n/an/a 3.04E+4n/an/an/an/an/an/a



Hefei University of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOA using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate additio...


Eur J Med Chem 103: 185-90 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.055
BindingDB Entry DOI: 10.7270/Q29C7070
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50127229
PNG
(CHEMBL3629472)
Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)c2cc3ccc(C)cc3oc2=O)cc1
Show InChI InChI=1S/C30H26O6/c1-19-5-9-22-17-26(30(32)36-28(22)15-19)27(31)14-13-25-21(16-24(34-3)18-29(25)35-4)10-6-20-7-11-23(33-2)12-8-20/h5-18H,1-4H3/b10-6+,14-13+
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n/an/a 2.78E+3n/an/an/an/an/an/a



Hefei University of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOB using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate additio...


Eur J Med Chem 103: 185-90 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.055
BindingDB Entry DOI: 10.7270/Q29C7070
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50127229
PNG
(CHEMBL3629472)
Show SMILES COc1ccc(\C=C\c2cc(OC)cc(OC)c2\C=C\C(=O)c2cc3ccc(C)cc3oc2=O)cc1
Show InChI InChI=1S/C30H26O6/c1-19-5-9-22-17-26(30(32)36-28(22)15-19)27(31)14-13-25-21(16-24(34-3)18-29(25)35-4)10-6-20-7-11-23(33-2)12-8-20/h5-18H,1-4H3/b10-6+,14-13+
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n/an/a 5.82E+4n/an/an/an/an/an/a



Hefei University of Technology

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOA using p-tyramine as substrate assessed as H2O2 production preincubated for 15 mins followed by substrate additio...


Eur J Med Chem 103: 185-90 (2015)


Article DOI: 10.1016/j.ejmech.2015.08.055
BindingDB Entry DOI: 10.7270/Q29C7070
More data for this
Ligand-Target Pair