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Patent code US8802679

Compile Data Set for Download or QSAR
Found 44 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Membrane primary amine oxidase


(Rattus norvegicus (Rat))		BDBM128994
PNG
(US8802679, 75)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCCC1)C(=O)CN
Show InChI InChI=1S/C18H23N5O/c1-22(17(24)10-19)13-14-5-4-6-15(9-14)16-11-20-18(21-12-16)23-7-2-3-8-23/h4-6,9,11-12H,2-3,7-8,10,13,19H2,1H3
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n/an/a 3.60n/an/an/an/an/a25



Astellas Pharma Inc.

US Patent


Assay Description
A rat VAP-enzyme 1 (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme suspe...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Rattus norvegicus (Rat))		BDBM128992
PNG
(US8802679, 66)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCN(CC1)c1ncc(CCC(O)=O)cc1C)C(=O)CN
Show InChI InChI=1S/C27H33N7O3/c1-19-12-20(6-7-25(36)37)15-29-26(19)33-8-10-34(11-9-33)27-30-16-23(17-31-27)22-5-3-4-21(13-22)18-32(2)24(35)14-28/h3-5,12-13,15-17H,6-11,14,18,28H2,1-2H3,(H,36,37)
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Astellas Pharma Inc.

US Patent


Assay Description
A rat VAP-enzyme 1 (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme suspe...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Rattus norvegicus (Rat))		BDBM129000
PNG
(US8802679, 95)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1Cc2cccnc2C1)C(=O)CN
Show InChI InChI=1S/C21H22N6O/c1-26(20(28)9-22)12-15-4-2-5-16(8-15)18-10-24-21(25-11-18)27-13-17-6-3-7-23-19(17)14-27/h2-8,10-11H,9,12-14,22H2,1H3
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Astellas Pharma Inc.

US Patent


Assay Description
A rat VAP-enzyme 1 (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme suspe...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))		BDBM128988
PNG
(US8802679, 19)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCN(CC1)c1ncc(\C=C\C(O)=O)cc1C)C(=O)CN
Show InChI InChI=1S/C27H31N7O3/c1-19-12-20(6-7-25(36)37)15-29-26(19)33-8-10-34(11-9-33)27-30-16-23(17-31-27)22-5-3-4-21(13-22)18-32(2)24(35)14-28/h3-7,12-13,15-17H,8-11,14,18,28H2,1-2H3,(H,36,37)/b7-6+
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Astellas Pharma Inc.

US Patent


Assay Description
A human VAP-1 enzyme (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme sus...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Rattus norvegicus (Rat))		BDBM128988
PNG
(US8802679, 19)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCN(CC1)c1ncc(\C=C\C(O)=O)cc1C)C(=O)CN
Show InChI InChI=1S/C27H31N7O3/c1-19-12-20(6-7-25(36)37)15-29-26(19)33-8-10-34(11-9-33)27-30-16-23(17-31-27)22-5-3-4-21(13-22)18-32(2)24(35)14-28/h3-7,12-13,15-17H,8-11,14,18,28H2,1-2H3,(H,36,37)/b7-6+
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Astellas Pharma Inc.

US Patent


Assay Description
A rat VAP-enzyme 1 (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme suspe...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))		BDBM129004
PNG
(US8802679, 191)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCC(=CC1)c1cccnc1)C(=O)CN |c:20|
Show InChI InChI=1S/C24H26N6O/c1-29(23(31)13-25)17-18-4-2-5-20(12-18)22-15-27-24(28-16-22)30-10-7-19(8-11-30)21-6-3-9-26-14-21/h2-7,9,12,14-16H,8,10-11,13,17,25H2,1H3
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Astellas Pharma Inc.

US Patent


Assay Description
A human VAP-1 enzyme (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme sus...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Rattus norvegicus (Rat))		BDBM128987
PNG
(US8802679, 16)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CC[C@H](F)C1)C(=O)CN |r|
Show InChI InChI=1S/C18H22FN5O/c1-23(17(25)8-20)11-13-3-2-4-14(7-13)15-9-21-18(22-10-15)24-6-5-16(19)12-24/h2-4,7,9-10,16H,5-6,8,11-12,20H2,1H3/t16-/m0/s1
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Astellas Pharma Inc.

US Patent


Assay Description
A rat VAP-enzyme 1 (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme suspe...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))		BDBM128992
PNG
(US8802679, 66)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCN(CC1)c1ncc(CCC(O)=O)cc1C)C(=O)CN
Show InChI InChI=1S/C27H33N7O3/c1-19-12-20(6-7-25(36)37)15-29-26(19)33-8-10-34(11-9-33)27-30-16-23(17-31-27)22-5-3-4-21(13-22)18-32(2)24(35)14-28/h3-5,12-13,15-17H,6-11,14,18,28H2,1-2H3,(H,36,37)
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Astellas Pharma Inc.

US Patent


Assay Description
A human VAP-1 enzyme (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme sus...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Rattus norvegicus (Rat))		BDBM128993
PNG
(US8802679, 69)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCOCC1)C(=O)CN
Show InChI InChI=1S/C18H23N5O2/c1-22(17(24)10-19)13-14-3-2-4-15(9-14)16-11-20-18(21-12-16)23-5-7-25-8-6-23/h2-4,9,11-12H,5-8,10,13,19H2,1H3
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Astellas Pharma Inc.

US Patent


Assay Description
A rat VAP-enzyme 1 (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme suspe...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Rattus norvegicus (Rat))		BDBM128989
PNG
(US8802679, 32)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCN(CC1)c1ncc(cc1Cl)C(O)=O)C(=O)CN
Show InChI InChI=1S/C24H26ClN7O3/c1-30(21(33)11-26)15-16-3-2-4-17(9-16)19-13-28-24(29-14-19)32-7-5-31(6-8-32)22-20(25)10-18(12-27-22)23(34)35/h2-4,9-10,12-14H,5-8,11,15,26H2,1H3,(H,34,35)
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Astellas Pharma Inc.

US Patent


Assay Description
A rat VAP-enzyme 1 (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme suspe...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))		BDBM129000
PNG
(US8802679, 95)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1Cc2cccnc2C1)C(=O)CN
Show InChI InChI=1S/C21H22N6O/c1-26(20(28)9-22)12-15-4-2-5-16(8-15)18-10-24-21(25-11-18)27-13-17-6-3-7-23-19(17)14-27/h2-8,10-11H,9,12-14,22H2,1H3
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Astellas Pharma Inc.

US Patent


Assay Description
A human VAP-1 enzyme (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme sus...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Rattus norvegicus (Rat))		BDBM128999
PNG
(US8802679, 91)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCN(CC1)c1cccnc1C)C(=O)CN
Show InChI InChI=1S/C24H29N7O/c1-18-22(7-4-8-26-18)30-9-11-31(12-10-30)24-27-15-21(16-28-24)20-6-3-5-19(13-20)17-29(2)23(32)14-25/h3-8,13,15-16H,9-12,14,17,25H2,1-2H3
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Astellas Pharma Inc.

US Patent


Assay Description
A rat VAP-enzyme 1 (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme suspe...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Rattus norvegicus (Rat))		BDBM129001
PNG
(US8802679, 102)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCc2nc(C)sc2C1)C(=O)CN
Show InChI InChI=1S/C21H24N6OS/c1-14-25-18-6-7-27(13-19(18)29-14)21-23-10-17(11-24-21)16-5-3-4-15(8-16)12-26(2)20(28)9-22/h3-5,8,10-11H,6-7,9,12-13,22H2,1-2H3
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Astellas Pharma Inc.

US Patent


Assay Description
A rat VAP-enzyme 1 (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme suspe...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Rattus norvegicus (Rat))		BDBM129004
PNG
(US8802679, 191)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCC(=CC1)c1cccnc1)C(=O)CN |c:20|
Show InChI InChI=1S/C24H26N6O/c1-29(23(31)13-25)17-18-4-2-5-20(12-18)22-15-27-24(28-16-22)30-10-7-19(8-11-30)21-6-3-9-26-14-21/h2-7,9,12,14-16H,8,10-11,13,17,25H2,1H3
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Astellas Pharma Inc.

US Patent


Assay Description
A rat VAP-enzyme 1 (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme suspe...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Rattus norvegicus (Rat))		BDBM128998
PNG
(US8802679, 84)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCC(O)CC1)C(=O)CN
Show InChI InChI=1S/C19H25N5O2/c1-23(18(26)10-20)13-14-3-2-4-15(9-14)16-11-21-19(22-12-16)24-7-5-17(25)6-8-24/h2-4,9,11-12,17,25H,5-8,10,13,20H2,1H3
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Astellas Pharma Inc.

US Patent


Assay Description
A rat VAP-enzyme 1 (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme suspe...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Rattus norvegicus (Rat))		BDBM129007
PNG
(US8802679, 263)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCN(CC1)c1ccc(cc1Cl)C(O)=O)C(=O)CN
Show InChI InChI=1S/C25H27ClN6O3/c1-30(23(33)13-27)16-17-3-2-4-18(11-17)20-14-28-25(29-15-20)32-9-7-31(8-10-32)22-6-5-19(24(34)35)12-21(22)26/h2-6,11-12,14-15H,7-10,13,16,27H2,1H3,(H,34,35)
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Astellas Pharma Inc.

US Patent


Assay Description
A rat VAP-enzyme 1 (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme suspe...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))		BDBM129005
PNG
(US8802679, 216)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCS(=O)(=O)CC1)C(=O)CN
Show InChI InChI=1S/C18H23N5O3S/c1-22(17(24)10-19)13-14-3-2-4-15(9-14)16-11-20-18(21-12-16)23-5-7-27(25,26)8-6-23/h2-4,9,11-12H,5-8,10,13,19H2,1H3
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Astellas Pharma Inc.

US Patent


Assay Description
A human VAP-1 enzyme (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme sus...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))		BDBM128989
PNG
(US8802679, 32)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCN(CC1)c1ncc(cc1Cl)C(O)=O)C(=O)CN
Show InChI InChI=1S/C24H26ClN7O3/c1-30(21(33)11-26)15-16-3-2-4-17(9-16)19-13-28-24(29-14-19)32-7-5-31(6-8-32)22-20(25)10-18(12-27-22)23(34)35/h2-4,9-10,12-14H,5-8,11,15,26H2,1H3,(H,34,35)
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Astellas Pharma Inc.

US Patent


Assay Description
A human VAP-1 enzyme (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme sus...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))		BDBM128999
PNG
(US8802679, 91)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCN(CC1)c1cccnc1C)C(=O)CN
Show InChI InChI=1S/C24H29N7O/c1-18-22(7-4-8-26-18)30-9-11-31(12-10-30)24-27-15-21(16-28-24)20-6-3-5-19(13-20)17-29(2)23(32)14-25/h3-8,13,15-16H,9-12,14,17,25H2,1-2H3
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Astellas Pharma Inc.

US Patent


Assay Description
A human VAP-1 enzyme (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme sus...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Rattus norvegicus (Rat))		BDBM129003
PNG
(US8802679, 190)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCC(CC1)c1cccnc1)C(=O)CN
Show InChI InChI=1S/C24H28N6O/c1-29(23(31)13-25)17-18-4-2-5-20(12-18)22-15-27-24(28-16-22)30-10-7-19(8-11-30)21-6-3-9-26-14-21/h2-6,9,12,14-16,19H,7-8,10-11,13,17,25H2,1H3
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Astellas Pharma Inc.

US Patent


Assay Description
A rat VAP-enzyme 1 (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme suspe...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))		BDBM129001
PNG
(US8802679, 102)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCc2nc(C)sc2C1)C(=O)CN
Show InChI InChI=1S/C21H24N6OS/c1-14-25-18-6-7-27(13-19(18)29-14)21-23-10-17(11-24-21)16-5-3-4-15(8-16)12-26(2)20(28)9-22/h3-5,8,10-11H,6-7,9,12-13,22H2,1-2H3
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n/an/a 20n/an/an/an/an/a25



Astellas Pharma Inc.

US Patent


Assay Description
A human VAP-1 enzyme (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme sus...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Rattus norvegicus (Rat))		BDBM128991
PNG
(US8802679, 51)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCC(CC1)N1CCOCC1)C(=O)CN
Show InChI InChI=1S/C23H32N6O2/c1-27(22(30)14-24)17-18-3-2-4-19(13-18)20-15-25-23(26-16-20)29-7-5-21(6-8-29)28-9-11-31-12-10-28/h2-4,13,15-16,21H,5-12,14,17,24H2,1H3
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n/an/a 21n/an/an/an/an/a25



Astellas Pharma Inc.

US Patent


Assay Description
A rat VAP-enzyme 1 (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme suspe...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Rattus norvegicus (Rat))		BDBM128990
PNG
(US8802679, 33)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCN(CC1)c1ncc(\C=C\C(O)=O)cc1Cl)C(=O)CN
Show InChI InChI=1S/C26H28ClN7O3/c1-32(23(35)13-28)17-19-3-2-4-20(11-19)21-15-30-26(31-16-21)34-9-7-33(8-10-34)25-22(27)12-18(14-29-25)5-6-24(36)37/h2-6,11-12,14-16H,7-10,13,17,28H2,1H3,(H,36,37)/b6-5+
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n/an/a 21n/an/an/an/an/a25



Astellas Pharma Inc.

US Patent


Assay Description
A rat VAP-enzyme 1 (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme suspe...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Rattus norvegicus (Rat))		BDBM129005
PNG
(US8802679, 216)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCS(=O)(=O)CC1)C(=O)CN
Show InChI InChI=1S/C18H23N5O3S/c1-22(17(24)10-19)13-14-3-2-4-15(9-14)16-11-20-18(21-12-16)23-5-7-27(25,26)8-6-23/h2-4,9,11-12H,5-8,10,13,19H2,1H3
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n/an/a 21n/an/an/an/an/a25



Astellas Pharma Inc.

US Patent


Assay Description
A rat VAP-enzyme 1 (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme suspe...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Rattus norvegicus (Rat))		BDBM128986
PNG
(US8802679, 3)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCN(CC1)c1ncccc1C)C(=O)CN
Show InChI InChI=1S/C24H29N7O/c1-18-5-4-8-26-23(18)30-9-11-31(12-10-30)24-27-15-21(16-28-24)20-7-3-6-19(13-20)17-29(2)22(32)14-25/h3-8,13,15-16H,9-12,14,17,25H2,1-2H3
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Astellas Pharma Inc.

US Patent


Assay Description
A rat VAP-enzyme 1 (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme suspe...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))		BDBM129003
PNG
(US8802679, 190)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCC(CC1)c1cccnc1)C(=O)CN
Show InChI InChI=1S/C24H28N6O/c1-29(23(31)13-25)17-18-4-2-5-20(12-18)22-15-27-24(28-16-22)30-10-7-19(8-11-30)21-6-3-9-26-14-21/h2-6,9,12,14-16,19H,7-8,10-11,13,17,25H2,1H3
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n/an/a 23n/an/an/an/an/a25



Astellas Pharma Inc.

US Patent


Assay Description
A human VAP-1 enzyme (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme sus...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))		BDBM129007
PNG
(US8802679, 263)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCN(CC1)c1ccc(cc1Cl)C(O)=O)C(=O)CN
Show InChI InChI=1S/C25H27ClN6O3/c1-30(23(33)13-27)16-17-3-2-4-18(11-17)20-14-28-25(29-15-20)32-9-7-31(8-10-32)22-6-5-19(24(34)35)12-21(22)26/h2-6,11-12,14-15H,7-10,13,16,27H2,1H3,(H,34,35)
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Astellas Pharma Inc.

US Patent


Assay Description
A human VAP-1 enzyme (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme sus...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))		BDBM128990
PNG
(US8802679, 33)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCN(CC1)c1ncc(\C=C\C(O)=O)cc1Cl)C(=O)CN
Show InChI InChI=1S/C26H28ClN7O3/c1-32(23(35)13-28)17-19-3-2-4-20(11-19)21-15-30-26(31-16-21)34-9-7-33(8-10-34)25-22(27)12-18(14-29-25)5-6-24(36)37/h2-6,11-12,14-16H,7-10,13,17,28H2,1H3,(H,36,37)/b6-5+
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Astellas Pharma Inc.

US Patent


Assay Description
A human VAP-1 enzyme (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme sus...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))		BDBM128993
PNG
(US8802679, 69)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCOCC1)C(=O)CN
Show InChI InChI=1S/C18H23N5O2/c1-22(17(24)10-19)13-14-3-2-4-15(9-14)16-11-20-18(21-12-16)23-5-7-25-8-6-23/h2-4,9,11-12H,5-8,10,13,19H2,1H3
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Astellas Pharma Inc.

US Patent


Assay Description
A human VAP-1 enzyme (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme sus...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))		BDBM128986
PNG
(US8802679, 3)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCN(CC1)c1ncccc1C)C(=O)CN
Show InChI InChI=1S/C24H29N7O/c1-18-5-4-8-26-23(18)30-9-11-31(12-10-30)24-27-15-21(16-28-24)20-7-3-6-19(13-20)17-29(2)22(32)14-25/h3-8,13,15-16H,9-12,14,17,25H2,1-2H3
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Astellas Pharma Inc.

US Patent


Assay Description
A human VAP-1 enzyme (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme sus...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Rattus norvegicus (Rat))		BDBM128996
PNG
(US8802679, 79)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCOC(CO)C1)C(=O)CN
Show InChI InChI=1S/C19H25N5O3/c1-23(18(26)8-20)11-14-3-2-4-15(7-14)16-9-21-19(22-10-16)24-5-6-27-17(12-24)13-25/h2-4,7,9-10,17,25H,5-6,8,11-13,20H2,1H3
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Astellas Pharma Inc.

US Patent


Assay Description
A rat VAP-enzyme 1 (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme suspe...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Rattus norvegicus (Rat))		BDBM128997
PNG
(US8802679, 80)
Show SMILES C[C@H]1CN(C[C@@H](C)O1)c1ccc(cn1)-c1cccc(CN(C)C(=O)CN)c1 |r|
Show InChI InChI=1S/C21H28N4O2/c1-15-12-25(13-16(2)27-15)20-8-7-19(11-23-20)18-6-4-5-17(9-18)14-24(3)21(26)10-22/h4-9,11,15-16H,10,12-14,22H2,1-3H3/t15-,16+
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Astellas Pharma Inc.

US Patent


Assay Description
A rat VAP-enzyme 1 (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme suspe...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Rattus norvegicus (Rat))		BDBM129006
PNG
(US8802679, 261)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCN(CC1)c1ccc(nc1)C#N)C(=O)CN
Show InChI InChI=1S/C24H26N8O/c1-30(23(33)13-26)17-18-3-2-4-19(11-18)20-14-28-24(29-15-20)32-9-7-31(8-10-32)22-6-5-21(12-25)27-16-22/h2-6,11,14-16H,7-10,13,17,26H2,1H3
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n/an/a 40n/an/an/an/an/a25



Astellas Pharma Inc.

US Patent


Assay Description
A rat VAP-enzyme 1 (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme suspe...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Rattus norvegicus (Rat))		BDBM129002
PNG
(US8802679, 147)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCN(CC1)c1ncccc1Cl)C(=O)CN
Show InChI InChI=1S/C23H26ClN7O/c1-29(21(32)13-25)16-17-4-2-5-18(12-17)19-14-27-23(28-15-19)31-10-8-30(9-11-31)22-20(24)6-3-7-26-22/h2-7,12,14-15H,8-11,13,16,25H2,1H3
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Astellas Pharma Inc.

US Patent


Assay Description
A rat VAP-enzyme 1 (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme suspe...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))		BDBM128991
PNG
(US8802679, 51)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCC(CC1)N1CCOCC1)C(=O)CN
Show InChI InChI=1S/C23H32N6O2/c1-27(22(30)14-24)17-18-3-2-4-19(13-18)20-15-25-23(26-16-20)29-7-5-21(6-8-29)28-9-11-31-12-10-28/h2-4,13,15-16,21H,5-12,14,17,24H2,1H3
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Astellas Pharma Inc.

US Patent


Assay Description
A human VAP-1 enzyme (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme sus...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))		BDBM128987
PNG
(US8802679, 16)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CC[C@H](F)C1)C(=O)CN |r|
Show InChI InChI=1S/C18H22FN5O/c1-23(17(25)8-20)11-13-3-2-4-14(7-13)15-9-21-18(22-10-15)24-6-5-16(19)12-24/h2-4,7,9-10,16H,5-6,8,11-12,20H2,1H3/t16-/m0/s1
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Astellas Pharma Inc.

US Patent


Assay Description
A human VAP-1 enzyme (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme sus...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))		BDBM128994
PNG
(US8802679, 75)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCCC1)C(=O)CN
Show InChI InChI=1S/C18H23N5O/c1-22(17(24)10-19)13-14-5-4-6-15(9-14)16-11-20-18(21-12-16)23-7-2-3-8-23/h4-6,9,11-12H,2-3,7-8,10,13,19H2,1H3
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Astellas Pharma Inc.

US Patent


Assay Description
A human VAP-1 enzyme (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme sus...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))		BDBM128995
PNG
(US8802679, 78)
Show SMILES C[C@H]1CN(C[C@@H](C)O1)c1ncc(cn1)-c1cccc(CN(C)C(=O)CN)c1 |r|
Show InChI InChI=1S/C20H27N5O2/c1-14-11-25(12-15(2)27-14)20-22-9-18(10-23-20)17-6-4-5-16(7-17)13-24(3)19(26)8-21/h4-7,9-10,14-15H,8,11-13,21H2,1-3H3/t14-,15+
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n/an/a 61n/an/an/an/an/a25



Astellas Pharma Inc.

US Patent


Assay Description
A human VAP-1 enzyme (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme sus...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Rattus norvegicus (Rat))		BDBM128995
PNG
(US8802679, 78)
Show SMILES C[C@H]1CN(C[C@@H](C)O1)c1ncc(cn1)-c1cccc(CN(C)C(=O)CN)c1 |r|
Show InChI InChI=1S/C20H27N5O2/c1-14-11-25(12-15(2)27-14)20-22-9-18(10-23-20)17-6-4-5-16(7-17)13-24(3)19(26)8-21/h4-7,9-10,14-15H,8,11-13,21H2,1-3H3/t14-,15+
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Astellas Pharma Inc.

US Patent


Assay Description
A rat VAP-enzyme 1 (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme suspe...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))		BDBM128996
PNG
(US8802679, 79)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCOC(CO)C1)C(=O)CN
Show InChI InChI=1S/C19H25N5O3/c1-23(18(26)8-20)11-14-3-2-4-15(7-14)16-9-21-19(22-10-16)24-5-6-27-17(12-24)13-25/h2-4,7,9-10,17,25H,5-6,8,11-13,20H2,1H3
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Astellas Pharma Inc.

US Patent


Assay Description
A human VAP-1 enzyme (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme sus...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))		BDBM129002
PNG
(US8802679, 147)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCN(CC1)c1ncccc1Cl)C(=O)CN
Show InChI InChI=1S/C23H26ClN7O/c1-29(21(32)13-25)16-17-4-2-5-18(12-17)19-14-27-23(28-15-19)31-10-8-30(9-11-31)22-20(24)6-3-7-26-22/h2-7,12,14-15H,8-11,13,16,25H2,1H3
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n/an/a 72n/an/an/an/an/a25



Astellas Pharma Inc.

US Patent


Assay Description
A human VAP-1 enzyme (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme sus...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))		BDBM128997
PNG
(US8802679, 80)
Show SMILES C[C@H]1CN(C[C@@H](C)O1)c1ccc(cn1)-c1cccc(CN(C)C(=O)CN)c1 |r|
Show InChI InChI=1S/C21H28N4O2/c1-15-12-25(13-16(2)27-15)20-8-7-19(11-23-20)18-6-4-5-17(9-18)14-24(3)21(26)10-22/h4-9,11,15-16H,10,12-14,22H2,1-3H3/t15-,16+
PDB
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UniProtKB/SwissProt

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US Patent
n/an/a 81n/an/an/an/an/a25



Astellas Pharma Inc.

US Patent


Assay Description
A human VAP-1 enzyme (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme sus...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))		BDBM129006
PNG
(US8802679, 261)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCN(CC1)c1ccc(nc1)C#N)C(=O)CN
Show InChI InChI=1S/C24H26N8O/c1-30(23(33)13-26)17-18-3-2-4-19(11-18)20-14-28-24(29-15-20)32-9-7-31(8-10-32)22-6-5-21(12-25)27-16-22/h2-6,11,14-16H,7-10,13,17,26H2,1H3
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US Patent
n/an/a 90n/an/an/an/an/a25



Astellas Pharma Inc.

US Patent


Assay Description
A human VAP-1 enzyme (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme sus...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))		BDBM128998
PNG
(US8802679, 84)
Show SMILES CN(Cc1cccc(c1)-c1cnc(nc1)N1CCC(O)CC1)C(=O)CN
Show InChI InChI=1S/C19H25N5O2/c1-23(18(26)10-20)13-14-3-2-4-15(9-14)16-11-21-19(22-12-16)24-7-5-17(25)6-8-24/h2-4,9,11-12,17,25H,5-8,10,13,20H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 140n/an/an/an/an/a25



Astellas Pharma Inc.

US Patent


Assay Description
A human VAP-1 enzyme (SSAO) activity was measured by a radiochemistry-enzymatic assay using 14C-benzylamine as an artificial substrate. An enzyme sus...

US Patent US8802679 (2014)


BindingDB Entry DOI: 10.7270/Q2M61HZD
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%