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Patent code US10189854

Compile Data Set for Download or QSAR

Found 347 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
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332059
PNG
(Morpholin-4-yl-[1-(5-phenyl-pyrimidin-2-yl)-spiro[...)
Show SMILES O=C(N1CCOCC1)c1ccc2c(c1)N(CC21CC1)c1ncc(cn1)-c1ccccc1
Show InChI InChI=1S/C25H24N4O2/c30-23(28-10-12-31-13-11-28)19-6-7-21-22(14-19)29(17-25(21)8-9-25)24-26-15-20(16-27-24)18-4-2-1-3-5-18/h1-7,14-16H,8-13,17H2
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US Patent
n/an/a<100n/an/an/an/an/an/a



GRUENENTHAL GMBH

US Patent


Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332090
PNG
(US10189854, Compound 44 | [1-[5-(2-Fluorophenyl)-p...)
Show SMILES O[C@@H]1CCN(C1)C(=O)c1ccc2c(c1)N(CC21CC1)c1ncc(cn1)-c1ccccc1F
Show InChI InChI=1S/C25H23FN4O2/c26-21-4-2-1-3-19(21)17-12-27-24(28-13-17)30-15-25(8-9-25)20-6-5-16(11-22(20)30)23(32)29-10-7-18(31)14-29/h1-6,11-13,18,31H,7-10,14-15H2/t18-/m1/s1
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GRUENENTHAL GMBH

US Patent


Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332095
PNG
(US10189854, Compound 49 | [1-(5-Phenyl-pyrimidin-2...)
Show SMILES O=C(N1CCNCC1)c1ccc2c(c1)N(CC21CC1)c1ncc(cn1)-c1ccccc1
Show InChI InChI=1S/C25H25N5O/c31-23(29-12-10-26-11-13-29)19-6-7-21-22(14-19)30(17-25(21)8-9-25)24-27-15-20(16-28-24)18-4-2-1-3-5-18/h1-7,14-16,26H,8-13,17H2
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GRUENENTHAL GMBH

US Patent


Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332098
PNG
(US10189854, Compound 52 | [1-[5-(2-Fluoro-5-methyl...)
Show SMILES Cc1ccc(F)c(c1)-c1cnc(nc1)N1CC2(CC2)c2ccc(cc12)C(=O)N1CCOCC1
Show InChI InChI=1S/C26H25FN4O2/c1-17-2-5-22(27)20(12-17)19-14-28-25(29-15-19)31-16-26(6-7-26)21-4-3-18(13-23(21)31)24(32)30-8-10-33-11-9-30/h2-5,12-15H,6-11,16H2,1H3
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GRUENENTHAL GMBH

US Patent


Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332101
PNG
(4-[1-(5-Phenyl-pyrimidin-2-yl)-spiro[1,2-dihydro-i...)
Show SMILES O=C(N1CCNC(=O)C1)c1ccc2c(c1)N(CC21CC1)c1ncc(cn1)-c1ccccc1
Show InChI InChI=1S/C25H23N5O2/c31-22-15-29(11-10-26-22)23(32)18-6-7-20-21(12-18)30(16-25(20)8-9-25)24-27-13-19(14-28-24)17-4-2-1-3-5-17/h1-7,12-14H,8-11,15-16H2,(H,26,31)
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US Patent


Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332128
PNG
(US10189854, Compound 84 | [1-[5-(2-Fluorophenyl)-p...)
Show SMILES Fc1ccccc1-c1cnc(nc1)N1CC2(CC2)c2ccc(cc12)C(=O)N1CCCCC1
Show InChI InChI=1S/C26H25FN4O/c27-22-7-3-2-6-20(22)19-15-28-25(29-16-19)31-17-26(10-11-26)21-9-8-18(14-23(21)31)24(32)30-12-4-1-5-13-30/h2-3,6-9,14-16H,1,4-5,10-13,17H2
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US Patent


Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332162
PNG
(US10189854, Compound 121 | [1-[5-(2-Fluorophenyl)-...)
Show SMILES CN[C@@H]1CCN(C1)C(=O)c1ccc2c(c1)N(CC21CC1)c1ncc(cn1)-c1ccccc1F
Show InChI InChI=1S/C26H26FN5O/c1-28-19-8-11-31(15-19)24(33)17-6-7-21-23(12-17)32(16-26(21)9-10-26)25-29-13-18(14-30-25)20-4-2-3-5-22(20)27/h2-7,12-14,19,28H,8-11,15-16H2,1H3/t19-/m1/s1
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US Patent


Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332177
PNG
(US10189854, Compound 136 | [1-[5-(1-Methyl-1H-pyrr...)
Show SMILES Cn1ccc(c1)-c1cnc(nc1)N1CC2(CC2)c2ccc(cc12)C(=O)N1CCOCC1
Show InChI InChI=1S/C24H25N5O2/c1-27-7-4-18(15-27)19-13-25-23(26-14-19)29-16-24(5-6-24)20-3-2-17(12-21(20)29)22(30)28-8-10-31-11-9-28/h2-4,7,12-15H,5-6,8-11,16H2,1H3
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US Patent


Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332195
PNG
(US10189854, Compound 154 | [1-[5-(2,4-Dimethyl-thi...)
Show SMILES Cc1nc(C)c(s1)-c1cnc(nc1)N1CC2(CC2)c2ccc(cc12)C(=O)N1CCOCC1
Show InChI InChI=1S/C24H25N5O2S/c1-15-21(32-16(2)27-15)18-12-25-23(26-13-18)29-14-24(5-6-24)19-4-3-17(11-20(19)29)22(30)28-7-9-31-10-8-28/h3-4,11-13H,5-10,14H2,1-2H3
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US Patent


Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332227
PNG
(4-[1-[5-(3-Fluorophenyl)-pyrimidin-2-yl]-spiro[1,2...)
Show SMILES Fc1cccc(c1)-c1cnc(nc1)N1CC2(CC2)c2ccc(cc12)C(=O)N1CCNC(=O)C1
Show InChI InChI=1S/C25H22FN5O2/c26-19-3-1-2-16(10-19)18-12-28-24(29-13-18)31-15-25(6-7-25)20-5-4-17(11-21(20)31)23(33)30-9-8-27-22(32)14-30/h1-5,10-13H,6-9,14-15H2,(H,27,32)
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US Patent


Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332237
PNG
(1-[5-(3-Carbamoyl-phenyl)-pyrimidin-2-yl]-N-(2-hyd...)
Show SMILES CN(CCO)C(=O)c1ccc2c(c1)N(CC21CC1)c1ncc(cn1)-c1cccc(c1)C(N)=O
Show InChI InChI=1S/C25H25N5O3/c1-29(9-10-31)23(33)18-5-6-20-21(12-18)30(15-25(20)7-8-25)24-27-13-19(14-28-24)16-3-2-4-17(11-16)22(26)32/h2-6,11-14,31H,7-10,15H2,1H3,(H2,26,32)
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US Patent


Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332249
PNG
(US10189854, Compound 212)
Show SMILES COc1cccc(c1)-c1cnc(nc1)N1CC2(CC2)c2ccc(cc12)C(=O)N1CC2CC1CN2
Show InChI InChI=1S/C27H27N5O2/c1-34-22-4-2-3-17(9-22)19-12-29-26(30-13-19)32-16-27(7-8-27)23-6-5-18(10-24(23)32)25(33)31-15-20-11-21(31)14-28-20/h2-6,9-10,12-13,20-21,28H,7-8,11,14-16H2,1H3
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US Patent


Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332264
PNG
(US10189854, Compound 227)
Show SMILES CN(CCO)C(=O)c1ccc2c(c1)N(CC21CC1)c1ncc(cn1)-c1cc(C)ccc1F
Show InChI InChI=1S/C25H25FN4O2/c1-16-3-6-21(26)19(11-16)18-13-27-24(28-14-18)30-15-25(7-8-25)20-5-4-17(12-22(20)30)23(32)29(2)9-10-31/h3-6,11-14,31H,7-10,15H2,1-2H3
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US Patent


Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332267
PNG
(US10189854, Compound 230)
Show SMILES CN(CCO)C(=O)c1ccc2c(c1)N(CC21CC1)c1ncc(cn1)-c1cccc(F)n1
Show InChI InChI=1S/C23H22FN5O2/c1-28(9-10-30)21(31)15-5-6-17-19(11-15)29(14-23(17)7-8-23)22-25-12-16(13-26-22)18-3-2-4-20(24)27-18/h2-6,11-13,30H,7-10,14H2,1H3
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US Patent


Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332268
PNG
(US10189854, Compound 231)
Show SMILES CN(CCO)C(=O)c1ccc2c(c1)N(CC21CC1)c1ncc(cn1)-c1ccnc(F)c1
Show InChI InChI=1S/C23H22FN5O2/c1-28(8-9-30)21(31)16-2-3-18-19(10-16)29(14-23(18)5-6-23)22-26-12-17(13-27-22)15-4-7-25-20(24)11-15/h2-4,7,10-13,30H,5-6,8-9,14H2,1H3
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US Patent


Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332270
PNG
(US10189854, Compound 233)
Show SMILES CN(CCO)C(=O)c1ccc2c(c1)N(CC21CC1)c1ncc(cn1)-c1cc(F)ccn1
Show InChI InChI=1S/C23H22FN5O2/c1-28(8-9-30)21(31)15-2-3-18-20(10-15)29(14-23(18)5-6-23)22-26-12-16(13-27-22)19-11-17(24)4-7-25-19/h2-4,7,10-13,30H,5-6,8-9,14H2,1H3
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US Patent


Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332294
PNG
(US10189854, Compound 258)
Show SMILES Nc1ccnc(c1)-c1cnc(nc1)N1CC2(CC2)c2ccc(cc12)C(=O)N1CCNC(=O)C1
Show InChI InChI=1S/C24H23N7O2/c25-17-3-6-26-19(10-17)16-11-28-23(29-12-16)31-14-24(4-5-24)18-2-1-15(9-20(18)31)22(33)30-8-7-27-21(32)13-30/h1-3,6,9-12H,4-5,7-8,13-14H2,(H2,25,26)(H,27,32)
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US Patent


Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332299
PNG
(US10189854, Compound 263)
Show SMILES Nc1ccnc(c1)-c1cnc(nc1)N1CC2(CC2)c2ccc(cc12)C(=O)N1CC2CC1CN2
Show InChI InChI=1S/C25H25N7O/c26-17-3-6-27-21(8-17)16-10-29-24(30-11-16)32-14-25(4-5-25)20-2-1-15(7-22(20)32)23(33)31-13-18-9-19(31)12-28-18/h1-3,6-8,10-11,18-19,28H,4-5,9,12-14H2,(H2,26,27)
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US Patent


Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332310
PNG
(US10189854, Compound 274)
Show SMILES O=C(N1CC2CC1CN2)c1ccc2c(c1)N(CC21CC1)c1ncc(cn1)-c1cccnn1
Show InChI InChI=1S/C24H23N7O/c32-22(30-13-17-9-18(30)12-25-17)15-3-4-19-21(8-15)31(14-24(19)5-6-24)23-26-10-16(11-27-23)20-2-1-7-28-29-20/h1-4,7-8,10-11,17-18,25H,5-6,9,12-14H2
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US Patent


Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332325
PNG
(US10189854, Compound 289)
Show SMILES CN(CCO)C(=O)c1ccc2c(c1)N(CC21CC1)c1ncc(cn1)-c1cc(ccn1)S(C)(=O)=O
Show InChI InChI=1S/C24H25N5O4S/c1-28(9-10-30)22(31)16-3-4-19-21(11-16)29(15-24(19)6-7-24)23-26-13-17(14-27-23)20-12-18(5-8-25-20)34(2,32)33/h3-5,8,11-14,30H,6-7,9-10,15H2,1-2H3
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US Patent


Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332330
PNG
(US10189854, Compound 294)
Show SMILES CC(C)(O)c1ccnc(c1)-c1cnc(nc1)N1CC2(CC2)c2ccc(cc12)C(=O)N1CCOCC1
Show InChI InChI=1S/C27H29N5O3/c1-26(2,34)20-5-8-28-22(14-20)19-15-29-25(30-16-19)32-17-27(6-7-27)21-4-3-18(13-23(21)32)24(33)31-9-11-35-12-10-31/h3-5,8,13-16,34H,6-7,9-12,17H2,1-2H3
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US Patent


Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332331
PNG
(US10189854, Compound 295)
Show SMILES O=C(N1CCOCC1)c1ccc2c(c1)N(CC21CC1)c1ncc(cn1)-c1cc(NCC2CC2)ccn1
Show InChI InChI=1S/C28H30N6O2/c35-26(33-9-11-36-12-10-33)20-3-4-23-25(13-20)34(18-28(23)6-7-28)27-31-16-21(17-32-27)24-14-22(5-8-29-24)30-15-19-1-2-19/h3-5,8,13-14,16-17,19H,1-2,6-7,9-12,15,18H2,(H,29,30)
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Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332334
PNG
(US10189854, Compound 298)
Show SMILES CCc1ccnc(c1)-c1cnc(nc1)N1CC2(CC2)c2ccc(cc12)C(=O)N1C[C@@H]2C[C@H]1CN2
Show InChI InChI=1S/C27H28N6O/c1-2-17-5-8-28-23(9-17)19-12-30-26(31-13-19)33-16-27(6-7-27)22-4-3-18(10-24(22)33)25(34)32-15-20-11-21(32)14-29-20/h3-5,8-10,12-13,20-21,29H,2,6-7,11,14-16H2,1H3/t20-,21-/m0/s1
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Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332339
PNG
(US10189854, Compound 303)
Show SMILES CN(C)C(=O)c1ccc2c(c1)N(CC21CC1)c1ncc(cn1)-c1cccc(C)n1
Show InChI InChI=1S/C23H23N5O/c1-15-5-4-6-19(26-15)17-12-24-22(25-13-17)28-14-23(9-10-23)18-8-7-16(11-20(18)28)21(29)27(2)3/h4-8,11-13H,9-10,14H2,1-3H3
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Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332349
PNG
(US10189854, Compound 313)
Show SMILES OC[C@@H]1CCCN(C1)C(=O)c1ccc2c(c1)N(CC21CC1)c1ncc(cn1)-c1ccccc1F
Show InChI InChI=1S/C27H27FN4O2/c28-23-6-2-1-5-21(23)20-13-29-26(30-14-20)32-17-27(9-10-27)22-8-7-19(12-24(22)32)25(34)31-11-3-4-18(15-31)16-33/h1-2,5-8,12-14,18,33H,3-4,9-11,15-17H2/t18-/m1/s1
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Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332370
PNG
(US10189854, Compound 334)
Show SMILES Cc1ccnc(c1)-c1cnc(nc1)N1CC2(CC2)c2ccc(cc12)C(=O)N1CC[C@@H](N)C1
Show InChI InChI=1S/C25H26N6O/c1-16-4-8-27-21(10-16)18-12-28-24(29-13-18)31-15-25(6-7-25)20-3-2-17(11-22(20)31)23(32)30-9-5-19(26)14-30/h2-4,8,10-13,19H,5-7,9,14-15,26H2,1H3/t19-/m1/s1
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Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332373
PNG
(US10189854, Compound 337)
Show SMILES CN(CC(N)=O)C(=O)c1ccc2c(c1)N(CC21CC1)c1ncc(cn1)-c1cc(ccn1)C1CC1
Show InChI InChI=1S/C26H26N6O2/c1-31(14-23(27)33)24(34)18-4-5-20-22(11-18)32(15-26(20)7-8-26)25-29-12-19(13-30-25)21-10-17(6-9-28-21)16-2-3-16/h4-6,9-13,16H,2-3,7-8,14-15H2,1H3,(H2,27,33)
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Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332374
PNG
(US10189854, Compound 338)
Show SMILES CC(=O)Nc1ccnc(c1)-c1cnc(nc1)N1CC2(CC2)c2ccc(cc12)C(=O)N1C[C@@H]2C[C@H]1CN2
Show InChI InChI=1S/C27H27N7O2/c1-16(35)32-19-4-7-28-23(10-19)18-11-30-26(31-12-18)34-15-27(5-6-27)22-3-2-17(8-24(22)34)25(36)33-14-20-9-21(33)13-29-20/h2-4,7-8,10-12,20-21,29H,5-6,9,13-15H2,1H3,(H,28,32,35)/t20-,21-/m0/s1
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Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332379
PNG
(US10189854, Compound 343)
Show SMILES CCNc1ccc(F)c(c1)-c1cnc(nc1)N1CC2(CC2)c2ccc(cc12)C(=O)N(C)CCO
Show InChI InChI=1S/C26H28FN5O2/c1-3-28-19-5-7-22(27)20(13-19)18-14-29-25(30-15-18)32-16-26(8-9-26)21-6-4-17(12-23(21)32)24(34)31(2)10-11-33/h4-7,12-15,28,33H,3,8-11,16H2,1-2H3
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Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332380
PNG
(US10189854, Compound 344)
Show SMILES CS(=O)c1ccnc(c1)-c1cnc(nc1)N1CC2(CC2)c2ccc(cc12)C(=O)N1CCOCC1
Show InChI InChI=1S/C25H25N5O3S/c1-34(32)19-4-7-26-21(13-19)18-14-27-24(28-15-18)30-16-25(5-6-25)20-3-2-17(12-22(20)30)23(31)29-8-10-33-11-9-29/h2-4,7,12-15H,5-6,8-11,16H2,1H3
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Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332384
PNG
(US10189854, Compound 348)
Show SMILES CN(CCO)C(=O)c1ccc2c(c1)N(CC21CC1)c1ncc(cn1)-c1cc(cs1)C(N)=O
Show InChI InChI=1S/C23H23N5O3S/c1-27(6-7-29)21(31)14-2-3-17-18(8-14)28(13-23(17)4-5-23)22-25-10-16(11-26-22)19-9-15(12-32-19)20(24)30/h2-3,8-12,29H,4-7,13H2,1H3,(H2,24,30)
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Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332055
PNG
(US10189854, Compound 3 | [1-[5-(1-Fluorophenyl)-py...)
Show SMILES F[C]1(=CC=CC=C1)c1cnc(nc1)N1CC2(CC2)c2ccc(cc12)C(=O)N1CCCC1
Show InChI InChI=1S/C25H24FN4O/c26-25(8-2-1-3-9-25)19-15-27-23(28-16-19)30-17-24(10-11-24)20-7-6-18(14-21(20)30)22(31)29-12-4-5-13-29/h1-3,6-9,14-16H,4-5,10-13,17H2
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Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332063
PNG
(US10189854, Compound 15 | [1-[5-(2,3-Difluoro-phen...)
Show SMILES Fc1cccc(c1F)-c1cnc(nc1)N1CC2(CC2)c2ccc(cc12)C(=O)N1CCOCC1
Show InChI InChI=1S/C25H22F2N4O2/c26-20-3-1-2-18(22(20)27)17-13-28-24(29-14-17)31-15-25(6-7-25)19-5-4-16(12-21(19)31)23(32)30-8-10-33-11-9-30/h1-5,12-14H,6-11,15H2
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Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332075
PNG
(US10189854, Compound 27 | [1-[5-(2,6-Difluoro-phen...)
Show SMILES Fc1cccc(F)c1-c1cnc(nc1)N1CC2(CC2)c2ccc(cc12)C(=O)N1CCOCC1
Show InChI InChI=1S/C25H22F2N4O2/c26-19-2-1-3-20(27)22(19)17-13-28-24(29-14-17)31-15-25(6-7-25)18-5-4-16(12-21(18)31)23(32)30-8-10-33-11-9-30/h1-5,12-14H,6-11,15H2
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Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332081
PNG
(US10189854, Compound 34 | US10189854, Compound 94 ...)
Show SMILES OCCN1CCN(CC1)C(=O)c1ccc2c(c1)N(CC21CC1)c1ncc(cn1)-c1ccccc1F
Show InChI InChI=1S/C27H28FN5O2/c28-23-4-2-1-3-21(23)20-16-29-26(30-17-20)33-18-27(7-8-27)22-6-5-19(15-24(22)33)25(35)32-11-9-31(10-12-32)13-14-34/h1-6,15-17,34H,7-14,18H2
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Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332103
PNG
(US10189854, Compound 57 | [1-[5-(3-Fluorophenyl)-p...)
Show SMILES Fc1cccc(c1)-c1cnc(nc1)N1CC2(CC2)c2ccc(cc12)C(=O)N1CCOCC1
Show InChI InChI=1S/C25H23FN4O2/c26-20-3-1-2-17(12-20)19-14-27-24(28-15-19)30-16-25(6-7-25)21-5-4-18(13-22(21)30)23(31)29-8-10-32-11-9-29/h1-5,12-15H,6-11,16H2
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Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332111
PNG
(3-Fluoro-N,N-dimethyl-4-[2-[6-(morpholine-4-carbon...)
Show SMILES CN(C)C(=O)c1ccc(c(F)c1)-c1cnc(nc1)N1CC2(CC2)c2ccc(cc12)C(=O)N1CCOCC1
Show InChI InChI=1S/C28H28FN5O3/c1-32(2)25(35)18-3-5-21(23(29)13-18)20-15-30-27(31-16-20)34-17-28(7-8-28)22-6-4-19(14-24(22)34)26(36)33-9-11-37-12-10-33/h3-6,13-16H,7-12,17H2,1-2H3
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Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332147
PNG
(US10189854, Compound 103 | [1-[5-(2-Fluorophenyl)-...)
Show SMILES CC1COCCN1C(=O)c1ccc2c(c1)N(CC21CC1)c1ncc(cn1)-c1ccccc1F
Show InChI InChI=1S/C26H25FN4O2/c1-17-15-33-11-10-30(17)24(32)18-6-7-21-23(12-18)31(16-26(21)8-9-26)25-28-13-19(14-29-25)20-4-2-3-5-22(20)27/h2-7,12-14,17H,8-11,15-16H2,1H3
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Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332151
PNG
((2,5-Diazabicyclo[2.2.1]heptan-2-yl)-[1-[5-(2-fluo...)
Show SMILES Fc1ccccc1-c1cnc(nc1)N1CC2(CC2)c2ccc(cc12)C(=O)N1CC2CC1CN2
Show InChI InChI=1S/C26H24FN5O/c27-22-4-2-1-3-20(22)17-11-29-25(30-12-17)32-15-26(7-8-26)21-6-5-16(9-23(21)32)24(33)31-14-18-10-19(31)13-28-18/h1-6,9,11-12,18-19,28H,7-8,10,13-15H2
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Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332157
PNG
(US10189854, Compound 114 | [(3R)-3-Amino-pyrrolidi...)
Show SMILES N[C@@H]1CCN(C1)C(=O)c1ccc2c(c1)N(CC21CC1)c1ncc(cn1)-c1cccc(F)c1F
Show InChI InChI=1S/C25H23F2N5O/c26-20-3-1-2-18(22(20)27)16-11-29-24(30-12-16)32-14-25(7-8-25)19-5-4-15(10-21(19)32)23(33)31-9-6-17(28)13-31/h1-5,10-12,17H,6-9,13-14,28H2/t17-/m1/s1
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Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332158
PNG
(US10189854, Compound 115 | [(3S)-3-Amino-pyrrolidi...)
Show SMILES N[C@H]1CCN(C1)C(=O)c1ccc2c(c1)N(CC21CC1)c1ncc(cn1)-c1ccccc1F
Show InChI InChI=1S/C25H24FN5O/c26-21-4-2-1-3-19(21)17-12-28-24(29-13-17)31-15-25(8-9-25)20-6-5-16(11-22(20)31)23(32)30-10-7-18(27)14-30/h1-6,11-13,18H,7-10,14-15,27H2/t18-/m0/s1
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Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332160
PNG
(3-[2-[6-[(3R)-3-Amino-pyrrolidine-1-carbonyl]-spir...)
Show SMILES N[C@@H]1CCN(C1)C(=O)c1ccc2c(c1)N(CC21CC1)c1ncc(cn1)-c1cccc(c1)C(N)=O
Show InChI InChI=1S/C26H26N6O2/c27-20-6-9-31(14-20)24(34)18-4-5-21-22(11-18)32(15-26(21)7-8-26)25-29-12-19(13-30-25)16-2-1-3-17(10-16)23(28)33/h1-5,10-13,20H,6-9,14-15,27H2,(H2,28,33)/t20-/m1/s1
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Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332166
PNG
(1-[5-(3-Fluorophenyl)-pyrimidin-2-yl]-N,N-dimethyl...)
Show SMILES CN(C)C(=O)c1ccc2c(c1)N(CC21CC1)c1ncc(cn1)-c1cccc(F)c1
Show InChI InChI=1S/C23H21FN4O/c1-27(2)21(29)16-6-7-19-20(11-16)28(14-23(19)8-9-23)22-25-12-17(13-26-22)15-4-3-5-18(24)10-15/h3-7,10-13H,8-9,14H2,1-2H3
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US Patent
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GRUENENTHAL GMBH

US Patent


Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332192
PNG
(US10189854, Compound 151 | [1-[5-(6-Fluoro-pyridin...)
Show SMILES Fc1cccc(n1)-c1cnc(nc1)N1CC2(CC2)c2ccc(cc12)C(=O)N1CCOCC1
Show InChI InChI=1S/C24H22FN5O2/c25-21-3-1-2-19(28-21)17-13-26-23(27-14-17)30-15-24(6-7-24)18-5-4-16(12-20(18)30)22(31)29-8-10-32-11-9-29/h1-5,12-14H,6-11,15H2
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GRUENENTHAL GMBH

US Patent


Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332197
PNG
(5-[2-[6-(Morpholine-4-carbonyl)-spiro[1,2-dihydro-...)
Show SMILES NC(=O)c1ccc(o1)-c1cnc(nc1)N1CC2(CC2)c2ccc(cc12)C(=O)N1CCOCC1
Show InChI InChI=1S/C24H23N5O4/c25-21(30)20-4-3-19(33-20)16-12-26-23(27-13-16)29-14-24(5-6-24)17-2-1-15(11-18(17)29)22(31)28-7-9-32-10-8-28/h1-4,11-13H,5-10,14H2,(H2,25,30)
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GRUENENTHAL GMBH

US Patent


Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332200
PNG
(US10189854, Compound 159 | [1-[5-(2-Methyl-pyridin...)
Show SMILES Cc1cc(ccn1)-c1cnc(nc1)N1CC2(CC2)c2ccc(cc12)C(=O)N1CCOCC1
Show InChI InChI=1S/C25H25N5O2/c1-17-12-18(4-7-26-17)20-14-27-24(28-15-20)30-16-25(5-6-25)21-3-2-19(13-22(21)30)23(31)29-8-10-32-11-9-29/h2-4,7,12-15H,5-6,8-11,16H2,1H3
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GRUENENTHAL GMBH

US Patent


Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332202
PNG
(5-[2-[6-(Morpholine-4-carbonyl)-spiro[1,2-dihydro-...)
Show SMILES O=C(N1CCOCC1)c1ccc2c(c1)N(CC21CC1)c1ncc(cn1)-c1cc(cs1)C#N
Show InChI InChI=1S/C24H21N5O2S/c25-11-16-9-21(32-14-16)18-12-26-23(27-13-18)29-15-24(3-4-24)19-2-1-17(10-20(19)29)22(30)28-5-7-31-8-6-28/h1-2,9-10,12-14H,3-8,15H2
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GRUENENTHAL GMBH

US Patent


Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332207
PNG
(US10189854, Compound 166 | [1-[5-(3,5-Difluoro-pyr...)
Show SMILES Fc1cncc(F)c1-c1cnc(nc1)N1CC2(CC2)c2ccc(cc12)C(=O)N1CCOCC1
Show InChI InChI=1S/C24H21F2N5O2/c25-18-12-27-13-19(26)21(18)16-10-28-23(29-11-16)31-14-24(3-4-24)17-2-1-15(9-20(17)31)22(32)30-5-7-33-8-6-30/h1-2,9-13H,3-8,14H2
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GRUENENTHAL GMBH

US Patent


Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332208
PNG
(US10189854, Compound 167 | [1-[5-(2-Methyl-pyridin...)
Show SMILES Cc1ncccc1-c1cnc(nc1)N1CC2(CC2)c2ccc(cc12)C(=O)N1CCOCC1
Show InChI InChI=1S/C25H25N5O2/c1-17-20(3-2-8-26-17)19-14-27-24(28-15-19)30-16-25(6-7-25)21-5-4-18(13-22(21)30)23(31)29-9-11-32-12-10-29/h2-5,8,13-15H,6-7,9-12,16H2,1H3
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GRUENENTHAL GMBH

US Patent


Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM332229
PNG
(Morpholin-4-yl-[1-(5-pyrimidin-4-yl-pyrimidin-2-yl...)
Show SMILES O=C(N1CCOCC1)c1ccc2c(c1)N(CC21CC1)c1ncc(cn1)-c1ccncn1
Show InChI InChI=1S/C23H22N6O2/c30-21(28-7-9-31-10-8-28)16-1-2-18-20(11-16)29(14-23(18)4-5-23)22-25-12-17(13-26-22)19-3-6-24-15-27-19/h1-3,6,11-13,15H,4-5,7-10,14H2
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GRUENENTHAL GMBH

US Patent


Assay Description
The inhibiting effect of the compounds on the enzyme activity of human PDE4B1 was measured by the quantification of 5′-adenosine monophosphate ...


US Patent US10189854 (2019)

More data for this
Ligand-Target Pair
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