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Compile Data Set for Download or QSAR

Found 64 hits Enz. Inhib. hit(s) with all data for entry = 7465   
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
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196658
PNG
(US10202399, Example 15 | US9212147, 15)
Show SMILES Oc1cc(CCc2ccc(cc2)-c2ccccc2)n[nH]c1=O
Show InChI InChI=1S/C18H16N2O2/c21-17-12-16(19-20-18(17)22)11-8-13-6-9-15(10-7-13)14-4-2-1-3-5-14/h1-7,9-10,12H,8,11H2,(H,19,21)(H,20,22)
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n/an/a 1.20n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The DAAO inhibitory activity was measured by assaying the amount of hydrogen peroxide (H2O2) produced by reacting DAAO protein with flavin adenine di...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM50431067
PNG
(CHEMBL2338797 | US10202399, Example 18 | US1046366...)
Show SMILES Oc1cc(CCc2cccc(F)c2)n[nH]c1=O
Show InChI InChI=1S/C12H11FN2O2/c13-9-3-1-2-8(6-9)4-5-10-7-11(16)12(17)15-14-10/h1-3,6-7H,4-5H2,(H,14,16)(H,15,17)
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n/an/a 1.40n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The DAAO inhibitory activity was measured by assaying the amount of hydrogen peroxide (H2O2) produced by reacting DAAO protein with flavin adenine di...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM50431083
PNG
(CHEMBL2338803 | US10202399, Example 24 | US1046366...)
Show SMILES Oc1cc(CCc2cc(F)cc(F)c2)n[nH]c1=O
Show InChI InChI=1S/C12H10F2N2O2/c13-8-3-7(4-9(14)5-8)1-2-10-6-11(17)12(18)16-15-10/h3-6H,1-2H2,(H,15,17)(H,16,18)
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n/an/a 1.5n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The DAAO inhibitory activity was measured by assaying the amount of hydrogen peroxide (H2O2) produced by reacting DAAO protein with flavin adenine di...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM50431069
PNG
(CHEMBL2338795 | US10202399, Example 27 | US1046366...)
Show SMILES Oc1cc(CCc2ccccc2F)n[nH]c1=O
Show InChI InChI=1S/C12H11FN2O2/c13-10-4-2-1-3-8(10)5-6-9-7-11(16)12(17)15-14-9/h1-4,7H,5-6H2,(H,14,16)(H,15,17)
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n/an/a 2n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The DAAO inhibitory activity was measured by assaying the amount of hydrogen peroxide (H2O2) produced by reacting DAAO protein with flavin adenine di...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196659
PNG
(US9212147, 16)
Show SMILES OCc1cccc(CCc2cc(O)c(=O)[nH]n2)c1
Show InChI InChI=1S/C13H14N2O3/c16-8-10-3-1-2-9(6-10)4-5-11-7-12(17)13(18)15-14-11/h1-3,6-7,16H,4-5,8H2,(H,14,17)(H,15,18)
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n/an/a 2.10n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The DAAO inhibitory activity was measured by assaying the amount of hydrogen peroxide (H2O2) produced by reacting DAAO protein with flavin adenine di...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196675
PNG
(US10202399, Example 237 | US9212147, 237)
Show SMILES Oc1n[nH]c(COc2ccccc2)cc1=O
Show InChI InChI=1S/C11H10N2O3/c14-10-6-8(12-13-11(10)15)7-16-9-4-2-1-3-5-9/h1-6H,7H2,(H,12,14)(H,13,15)
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n/an/a 2.20n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The DAAO inhibitory activity was measured by assaying the amount of hydrogen peroxide (H2O2) produced by reacting DAAO protein with flavin adenine di...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196661
PNG
(US10202399, Example 21 | US10463663, Example 17 | ...)
Show SMILES Oc1cc(CCc2ccc(F)cc2F)n[nH]c1=O
Show InChI InChI=1S/C12H10F2N2O2/c13-8-3-1-7(10(14)5-8)2-4-9-6-11(17)12(18)16-15-9/h1,3,5-6H,2,4H2,(H,15,17)(H,16,18)
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n/an/a 2.20n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The DAAO inhibitory activity was measured by assaying the amount of hydrogen peroxide (H2O2) produced by reacting DAAO protein with flavin adenine di...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196674
PNG
(US10202399, Example 232 | US9212147, 232)
Show SMILES Oc1n[nH]c(COc2cccc(F)c2)cc1=O
Show InChI InChI=1S/C11H9FN2O3/c12-7-2-1-3-9(4-7)17-6-8-5-10(15)11(16)14-13-8/h1-5H,6H2,(H,13,15)(H,14,16)
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n/an/a 2.30n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The DAAO inhibitory activity was measured by assaying the amount of hydrogen peroxide (H2O2) produced by reacting DAAO protein with flavin adenine di...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196671
PNG
(US10202399, Example 56 | US9212147, 56)
Show SMILES Oc1cc(CCc2cccc3ccccc23)n[nH]c1=O
Show InChI InChI=1S/C16H14N2O2/c19-15-10-13(17-18-16(15)20)9-8-12-6-3-5-11-4-1-2-7-14(11)12/h1-7,10H,8-9H2,(H,17,19)(H,18,20)
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n/an/a 2.30n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The DAAO inhibitory activity was measured by assaying the amount of hydrogen peroxide (H2O2) produced by reacting DAAO protein with flavin adenine di...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196654
PNG
(US9212147, 1)
Show SMILES Oc1n[nH]c(\C=C\c2ccccc2)cc1=O
Show InChI InChI=1S/C12H10N2O2/c15-11-8-10(13-14-12(11)16)7-6-9-4-2-1-3-5-9/h1-8H,(H,13,15)(H,14,16)/b7-6+
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n/an/a 2.40n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
This test was performed by partially modifying the method of Philip et. al. (J. Biomol. Screen. Vol. 11, pp 481-487, 2006). HEK293 cells that stably ...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM50431066
PNG
(CHEMBL2338798 | US10202399, Example 17 | US1046366...)
Show SMILES Oc1cc(CCc2cccc(c2)C(F)(F)F)n[nH]c1=O
Show InChI InChI=1S/C13H11F3N2O2/c14-13(15,16)9-3-1-2-8(6-9)4-5-10-7-11(19)12(20)18-17-10/h1-3,6-7H,4-5H2,(H,17,19)(H,18,20)
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n/an/a 2.40n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The DAAO inhibitory activity was measured by assaying the amount of hydrogen peroxide (H2O2) produced by reacting DAAO protein with flavin adenine di...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196660
PNG
(US10202399, Example 20 | US9212147, 20)
Show SMILES Cc1cccc(CCc2cc(O)c(=O)[nH]n2)c1
Show InChI InChI=1S/C13H14N2O2/c1-9-3-2-4-10(7-9)5-6-11-8-12(16)13(17)15-14-11/h2-4,7-8H,5-6H2,1H3,(H,14,16)(H,15,17)
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n/an/a 2.5n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The DAAO inhibitory activity was measured by assaying the amount of hydrogen peroxide (H2O2) produced by reacting DAAO protein with flavin adenine di...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196670
PNG
(US10202399, Example 52 | US9212147, 52)
Show SMILES Oc1cc(CCCCc2ccccc2)n[nH]c1=O
Show InChI InChI=1S/C14H16N2O2/c17-13-10-12(15-16-14(13)18)9-5-4-8-11-6-2-1-3-7-11/h1-3,6-7,10H,4-5,8-9H2,(H,15,17)(H,16,18)
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n/an/a 2.5n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The DAAO inhibitory activity was measured by assaying the amount of hydrogen peroxide (H2O2) produced by reacting DAAO protein with flavin adenine di...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM50431074
PNG
(CHEMBL2338790 | US10463663, Example 27 | US1112982...)
Show SMILES Oc1cc(CCc2ccc(Cl)cc2)n[nH]c1=O
Show InChI InChI=1S/C12H11ClN2O2/c13-9-4-1-8(2-5-9)3-6-10-7-11(16)12(17)15-14-10/h1-2,4-5,7H,3,6H2,(H,14,16)(H,15,17)
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n/an/a 2.70n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The DAAO inhibitory activity was measured by assaying the amount of hydrogen peroxide (H2O2) produced by reacting DAAO protein with flavin adenine di...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196657
PNG
(US9212147, 14)
Show SMILES OCc1ccc(CCc2cc(O)c(=O)[nH]n2)cc1
Show InChI InChI=1S/C13H14N2O3/c16-8-10-3-1-9(2-4-10)5-6-11-7-12(17)13(18)15-14-11/h1-4,7,16H,5-6,8H2,(H,14,17)(H,15,18)
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n/an/a 2.90n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The DAAO inhibitory activity was measured by assaying the amount of hydrogen peroxide (H2O2) produced by reacting DAAO protein with flavin adenine di...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196673
PNG
(US10202399, Example 231 | US9212147, 231)
Show SMILES Oc1n[nH]c(COc2ccc(F)cc2)cc1=O
Show InChI InChI=1S/C11H9FN2O3/c12-7-1-3-9(4-2-7)17-6-8-5-10(15)11(16)14-13-8/h1-5H,6H2,(H,13,15)(H,14,16)
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n/an/a 2.90n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The DAAO inhibitory activity was measured by assaying the amount of hydrogen peroxide (H2O2) produced by reacting DAAO protein with flavin adenine di...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM50431086
PNG
(CHEMBL2338800 | US10202399, Example 212 | US104636...)
Show SMILES Oc1cc(CCc2ccc(F)cc2)n[nH]c1=O
Show InChI InChI=1S/C12H11FN2O2/c13-9-4-1-8(2-5-9)3-6-10-7-11(16)12(17)15-14-10/h1-2,4-5,7H,3,6H2,(H,14,16)(H,15,17)
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n/an/a 3.10n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The DAAO inhibitory activity was measured by assaying the amount of hydrogen peroxide (H2O2) produced by reacting DAAO protein with flavin adenine di...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196662
PNG
(US10202399, Example 22 | US9212147, 22)
Show SMILES Cc1ccccc1CCc1cc(O)c(=O)[nH]n1
Show InChI InChI=1S/C13H14N2O2/c1-9-4-2-3-5-10(9)6-7-11-8-12(16)13(17)15-14-11/h2-5,8H,6-7H2,1H3,(H,14,16)(H,15,17)
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n/an/a 3.30n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The DAAO inhibitory activity was measured by assaying the amount of hydrogen peroxide (H2O2) produced by reacting DAAO protein with flavin adenine di...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196655
PNG
(US10202399, Example 4 | US9212147, 4)
Show SMILES Oc1n[nH]c(COc2ccccc2F)cc1=O
Show InChI InChI=1S/C11H9FN2O3/c12-8-3-1-2-4-10(8)17-6-7-5-9(15)11(16)14-13-7/h1-5H,6H2,(H,13,15)(H,14,16)
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n/an/a 3.5n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The DAAO inhibitory activity was measured by assaying the amount of hydrogen peroxide (H2O2) produced by reacting DAAO protein with flavin adenine di...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196654
PNG
(US9212147, 1)
Show SMILES Oc1n[nH]c(\C=C\c2ccccc2)cc1=O
Show InChI InChI=1S/C12H10N2O2/c15-11-8-10(13-14-12(11)16)7-6-9-4-2-1-3-5-9/h1-8H,(H,13,15)(H,14,16)/b7-6+
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n/an/a 3.80n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The DAAO inhibitory activity was measured by assaying the amount of hydrogen peroxide (H2O2) produced by reacting DAAO protein with flavin adenine di...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM50431079
PNG
(CHEMBL2338785 | US10202399, Example 9 | US9180122,...)
Show SMILES Oc1cc(CCc2ccccc2)c[nH]c1=O
Show InChI InChI=1S/C13H13NO2/c15-12-8-11(9-14-13(12)16)7-6-10-4-2-1-3-5-10/h1-5,8-9,15H,6-7H2,(H,14,16)
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n/an/a 3.90n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The DAAO inhibitory activity was measured by assaying the amount of hydrogen peroxide (H2O2) produced by reacting DAAO protein with flavin adenine di...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM50431069
PNG
(CHEMBL2338795 | US10202399, Example 27 | US1046366...)
Show SMILES Oc1cc(CCc2ccccc2F)n[nH]c1=O
Show InChI InChI=1S/C12H11FN2O2/c13-10-4-2-1-3-8(10)5-6-9-7-11(16)12(17)15-14-9/h1-4,7H,5-6H2,(H,14,16)(H,15,17)
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n/an/a 4.40n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
This test was performed by partially modifying the method of Philip et. al. (J. Biomol. Screen. Vol. 11, pp 481-487, 2006). HEK293 cells that stably ...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196660
PNG
(US10202399, Example 20 | US9212147, 20)
Show SMILES Cc1cccc(CCc2cc(O)c(=O)[nH]n2)c1
Show InChI InChI=1S/C13H14N2O2/c1-9-3-2-4-10(7-9)5-6-11-8-12(16)13(17)15-14-11/h2-4,7-8H,5-6H2,1H3,(H,14,16)(H,15,17)
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n/an/a 4.60n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
This test was performed by partially modifying the method of Philip et. al. (J. Biomol. Screen. Vol. 11, pp 481-487, 2006). HEK293 cells that stably ...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196668
PNG
(US9212147, 40)
Show SMILES Oc1n[nH]c(CCC2CCCCC2)cc1=O
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n/an/a 4.70n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The DAAO inhibitory activity was measured by assaying the amount of hydrogen peroxide (H2O2) produced by reacting DAAO protein with flavin adenine di...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM50431077
PNG
(CHEMBL2338787 | US10202399, Example 48 | US1046366...)
Show SMILES CC(c1ccccc1)c1cc(O)c(=O)[nH]n1
Show InChI InChI=1S/C12H12N2O2/c1-8(9-5-3-2-4-6-9)10-7-11(15)12(16)14-13-10/h2-8H,1H3,(H,13,15)(H,14,16)
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The DAAO inhibitory activity was measured by assaying the amount of hydrogen peroxide (H2O2) produced by reacting DAAO protein with flavin adenine di...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196675
PNG
(US10202399, Example 237 | US9212147, 237)
Show SMILES Oc1n[nH]c(COc2ccccc2)cc1=O
Show InChI InChI=1S/C11H10N2O3/c14-10-6-8(12-13-11(10)15)7-16-9-4-2-1-3-5-9/h1-6H,7H2,(H,12,14)(H,13,15)
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
This test was performed by partially modifying the method of Philip et. al. (J. Biomol. Screen. Vol. 11, pp 481-487, 2006). HEK293 cells that stably ...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196669
PNG
(US9212147, 47)
Show SMILES OCc1ccc(SCc2cc(=O)c(O)n[nH]2)cc1
Show InChI InChI=1S/C12H12N2O3S/c15-6-8-1-3-10(4-2-8)18-7-9-5-11(16)12(17)14-13-9/h1-5,15H,6-7H2,(H,13,16)(H,14,17)
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n/an/a 5.20n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The DAAO inhibitory activity was measured by assaying the amount of hydrogen peroxide (H2O2) produced by reacting DAAO protein with flavin adenine di...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196661
PNG
(US10202399, Example 21 | US10463663, Example 17 | ...)
Show SMILES Oc1cc(CCc2ccc(F)cc2F)n[nH]c1=O
Show InChI InChI=1S/C12H10F2N2O2/c13-8-3-1-7(10(14)5-8)2-4-9-6-11(17)12(18)16-15-9/h1,3,5-6H,2,4H2,(H,15,17)(H,16,18)
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n/an/a 5.5n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
This test was performed by partially modifying the method of Philip et. al. (J. Biomol. Screen. Vol. 11, pp 481-487, 2006). HEK293 cells that stably ...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM50431067
PNG
(CHEMBL2338797 | US10202399, Example 18 | US1046366...)
Show SMILES Oc1cc(CCc2cccc(F)c2)n[nH]c1=O
Show InChI InChI=1S/C12H11FN2O2/c13-9-3-1-2-8(6-9)4-5-10-7-11(16)12(17)15-14-10/h1-3,6-7H,4-5H2,(H,14,16)(H,15,17)
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n/an/a 6n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
This test was performed by partially modifying the method of Philip et. al. (J. Biomol. Screen. Vol. 11, pp 481-487, 2006). HEK293 cells that stably ...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196656
PNG
(US10202399, Example 13 | US9212147, 13)
Show SMILES Cc1ccc(CCc2cc(O)c(=O)[nH]n2)cc1
Show InChI InChI=1S/C13H14N2O2/c1-9-2-4-10(5-3-9)6-7-11-8-12(16)13(17)15-14-11/h2-5,8H,6-7H2,1H3,(H,14,16)(H,15,17)
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n/an/a 6.10n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The DAAO inhibitory activity was measured by assaying the amount of hydrogen peroxide (H2O2) produced by reacting DAAO protein with flavin adenine di...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM50431074
PNG
(CHEMBL2338790 | US10463663, Example 27 | US1112982...)
Show SMILES Oc1cc(CCc2ccc(Cl)cc2)n[nH]c1=O
Show InChI InChI=1S/C12H11ClN2O2/c13-9-4-1-8(2-5-9)3-6-10-7-11(16)12(17)15-14-10/h1-2,4-5,7H,3,6H2,(H,14,16)(H,15,17)
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n/an/a 6.30n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
This test was performed by partially modifying the method of Philip et. al. (J. Biomol. Screen. Vol. 11, pp 481-487, 2006). HEK293 cells that stably ...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196664
PNG
(US10202399, Example 25 | US9212147, 25)
Show SMILES CC(C)(C)c1ccc(CCc2cc(O)c(=O)[nH]n2)cc1
Show InChI InChI=1S/C16H20N2O2/c1-16(2,3)12-7-4-11(5-8-12)6-9-13-10-14(19)15(20)18-17-13/h4-5,7-8,10H,6,9H2,1-3H3,(H,17,19)(H,18,20)
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The DAAO inhibitory activity was measured by assaying the amount of hydrogen peroxide (H2O2) produced by reacting DAAO protein with flavin adenine di...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196667
PNG
(US10202399, Example 29 | US9212147, 29)
Show SMILES CCCCc1cc(O)c(=O)[nH]n1
Show InChI InChI=1S/C8H12N2O2/c1-2-3-4-6-5-7(11)8(12)10-9-6/h5H,2-4H2,1H3,(H,9,11)(H,10,12)
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n/an/a 6.90n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The DAAO inhibitory activity was measured by assaying the amount of hydrogen peroxide (H2O2) produced by reacting DAAO protein with flavin adenine di...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM50431083
PNG
(CHEMBL2338803 | US10202399, Example 24 | US1046366...)
Show SMILES Oc1cc(CCc2cc(F)cc(F)c2)n[nH]c1=O
Show InChI InChI=1S/C12H10F2N2O2/c13-8-3-7(4-9(14)5-8)1-2-10-6-11(17)12(18)16-15-10/h3-6H,1-2H2,(H,15,17)(H,16,18)
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n/an/a 7n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
This test was performed by partially modifying the method of Philip et. al. (J. Biomol. Screen. Vol. 11, pp 481-487, 2006). HEK293 cells that stably ...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM50431086
PNG
(CHEMBL2338800 | US10202399, Example 212 | US104636...)
Show SMILES Oc1cc(CCc2ccc(F)cc2)n[nH]c1=O
Show InChI InChI=1S/C12H11FN2O2/c13-9-4-1-8(2-5-9)3-6-10-7-11(16)12(17)15-14-10/h1-2,4-5,7H,3,6H2,(H,14,16)(H,15,17)
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n/an/a 7.20n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
This test was performed by partially modifying the method of Philip et. al. (J. Biomol. Screen. Vol. 11, pp 481-487, 2006). HEK293 cells that stably ...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196666
PNG
(US9212147, 28)
Show SMILES Oc1cc(CCc2ccc(cc2)C#CC(F)F)n[nH]c1=O
Show InChI InChI=1S/C13H11F3N2O3/c14-21(15)16-8-10-3-1-9(2-4-10)5-6-11-7-12(19)13(20)18-17-11/h1-4,7H,5-6H2,(H,17,19)(H,18,20)
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n/an/a 8.10n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The DAAO inhibitory activity was measured by assaying the amount of hydrogen peroxide (H2O2) produced by reacting DAAO protein with flavin adenine di...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196665
PNG
(US9212147, 26)
Show SMILES OCCCCc1cc(O)c(=O)[nH]n1
Show InChI InChI=1S/C8H12N2O3/c11-4-2-1-3-6-5-7(12)8(13)10-9-6/h5,11H,1-4H2,(H,9,12)(H,10,13)
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n/an/a 8.10n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The DAAO inhibitory activity was measured by assaying the amount of hydrogen peroxide (H2O2) produced by reacting DAAO protein with flavin adenine di...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM50431066
PNG
(CHEMBL2338798 | US10202399, Example 17 | US1046366...)
Show SMILES Oc1cc(CCc2cccc(c2)C(F)(F)F)n[nH]c1=O
Show InChI InChI=1S/C13H11F3N2O2/c14-13(15,16)9-3-1-2-8(6-9)4-5-10-7-11(19)12(20)18-17-10/h1-3,6-7H,4-5H2,(H,17,19)(H,18,20)
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n/an/a 8.30n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
This test was performed by partially modifying the method of Philip et. al. (J. Biomol. Screen. Vol. 11, pp 481-487, 2006). HEK293 cells that stably ...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196662
PNG
(US10202399, Example 22 | US9212147, 22)
Show SMILES Cc1ccccc1CCc1cc(O)c(=O)[nH]n1
Show InChI InChI=1S/C13H14N2O2/c1-9-4-2-3-5-10(9)6-7-11-8-12(16)13(17)15-14-11/h2-5,8H,6-7H2,1H3,(H,14,16)(H,15,17)
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
This test was performed by partially modifying the method of Philip et. al. (J. Biomol. Screen. Vol. 11, pp 481-487, 2006). HEK293 cells that stably ...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM50431068
PNG
(CHEMBL2338796 | US10202399, Example 30 | US1046366...)
Show SMILES Oc1cc(CCc2ccccc2C(F)(F)F)n[nH]c1=O
Show InChI InChI=1S/C13H11F3N2O2/c14-13(15,16)10-4-2-1-3-8(10)5-6-9-7-11(19)12(20)18-17-9/h1-4,7H,5-6H2,(H,17,19)(H,18,20)
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n/an/a 8.40n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The DAAO inhibitory activity was measured by assaying the amount of hydrogen peroxide (H2O2) produced by reacting DAAO protein with flavin adenine di...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196671
PNG
(US10202399, Example 56 | US9212147, 56)
Show SMILES Oc1cc(CCc2cccc3ccccc23)n[nH]c1=O
Show InChI InChI=1S/C16H14N2O2/c19-15-10-13(17-18-16(15)20)9-8-12-6-3-5-11-4-1-2-7-14(11)12/h1-7,10H,8-9H2,(H,17,19)(H,18,20)
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
This test was performed by partially modifying the method of Philip et. al. (J. Biomol. Screen. Vol. 11, pp 481-487, 2006). HEK293 cells that stably ...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196659
PNG
(US9212147, 16)
Show SMILES OCc1cccc(CCc2cc(O)c(=O)[nH]n2)c1
Show InChI InChI=1S/C13H14N2O3/c16-8-10-3-1-2-9(6-10)4-5-11-7-12(17)13(18)15-14-11/h1-3,6-7,16H,4-5,8H2,(H,14,17)(H,15,18)
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
This test was performed by partially modifying the method of Philip et. al. (J. Biomol. Screen. Vol. 11, pp 481-487, 2006). HEK293 cells that stably ...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196655
PNG
(US10202399, Example 4 | US9212147, 4)
Show SMILES Oc1n[nH]c(COc2ccccc2F)cc1=O
Show InChI InChI=1S/C11H9FN2O3/c12-8-3-1-2-4-10(8)17-6-7-5-9(15)11(16)14-13-7/h1-5H,6H2,(H,13,15)(H,14,16)
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
This test was performed by partially modifying the method of Philip et. al. (J. Biomol. Screen. Vol. 11, pp 481-487, 2006). HEK293 cells that stably ...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196668
PNG
(US9212147, 40)
Show SMILES Oc1n[nH]c(CCC2CCCCC2)cc1=O
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
This test was performed by partially modifying the method of Philip et. al. (J. Biomol. Screen. Vol. 11, pp 481-487, 2006). HEK293 cells that stably ...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196657
PNG
(US9212147, 14)
Show SMILES OCc1ccc(CCc2cc(O)c(=O)[nH]n2)cc1
Show InChI InChI=1S/C13H14N2O3/c16-8-10-3-1-9(2-4-10)5-6-11-7-12(17)13(18)15-14-11/h1-4,7,16H,5-6,8H2,(H,14,17)(H,15,18)
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n/an/a 10n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
This test was performed by partially modifying the method of Philip et. al. (J. Biomol. Screen. Vol. 11, pp 481-487, 2006). HEK293 cells that stably ...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196670
PNG
(US10202399, Example 52 | US9212147, 52)
Show SMILES Oc1cc(CCCCc2ccccc2)n[nH]c1=O
Show InChI InChI=1S/C14H16N2O2/c17-13-10-12(15-16-14(13)18)9-5-4-8-11-6-2-1-3-7-11/h1-3,6-7,10H,4-5,8-9H2,(H,15,17)(H,16,18)
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n/an/a 11n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
This test was performed by partially modifying the method of Philip et. al. (J. Biomol. Screen. Vol. 11, pp 481-487, 2006). HEK293 cells that stably ...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM50431077
PNG
(CHEMBL2338787 | US10202399, Example 48 | US1046366...)
Show SMILES CC(c1ccccc1)c1cc(O)c(=O)[nH]n1
Show InChI InChI=1S/C12H12N2O2/c1-8(9-5-3-2-4-6-9)10-7-11(15)12(16)14-13-10/h2-8H,1H3,(H,13,15)(H,14,16)
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n/an/a 11n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
This test was performed by partially modifying the method of Philip et. al. (J. Biomol. Screen. Vol. 11, pp 481-487, 2006). HEK293 cells that stably ...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM50431085
PNG
(CHEMBL2338801 | US10202399, Example 12 | US1046366...)
Show SMILES Oc1cc(CCc2ccc(cc2)C(F)(F)F)n[nH]c1=O
Show InChI InChI=1S/C13H11F3N2O2/c14-13(15,16)9-4-1-8(2-5-9)3-6-10-7-11(19)12(20)18-17-10/h1-2,4-5,7H,3,6H2,(H,17,19)(H,18,20)
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US Patent
n/an/a 12n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The DAAO inhibitory activity was measured by assaying the amount of hydrogen peroxide (H2O2) produced by reacting DAAO protein with flavin adenine di...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196669
PNG
(US9212147, 47)
Show SMILES OCc1ccc(SCc2cc(=O)c(O)n[nH]2)cc1
Show InChI InChI=1S/C12H12N2O3S/c15-6-8-1-3-10(4-2-8)18-7-9-5-11(16)12(17)14-13-9/h1-5,15H,6-7H2,(H,13,16)(H,14,17)
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n/an/a 12n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
This test was performed by partially modifying the method of Philip et. al. (J. Biomol. Screen. Vol. 11, pp 481-487, 2006). HEK293 cells that stably ...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
D-amino-acid oxidase


(Homo sapiens (Human))
BDBM196663
PNG
(US9212147, 23)
Show SMILES COc1cc(CO)cc(CCc2cc(O)c(=O)[nH]n2)c1
Show InChI InChI=1S/C14H16N2O4/c1-20-12-5-9(4-10(6-12)8-17)2-3-11-7-13(18)14(19)16-15-11/h4-7,17H,2-3,8H2,1H3,(H,15,18)(H,16,19)
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n/an/a 13n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The DAAO inhibitory activity was measured by assaying the amount of hydrogen peroxide (H2O2) produced by reacting DAAO protein with flavin adenine di...


US Patent US9212147 (2015)


BindingDB Entry DOI: 10.7270/Q29G5KKS
More data for this
Ligand-Target Pair
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