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PubMed code 23200255

Compile data set for download or QSAR
Found 50 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))
BDBM50428571
PNG
(CHEMBL2337964)
Show SMILES COc1ccc(C2=NN(CCCCOc3cccc(c3)C3=NNC(=O)C3(C)C)C(=O)CC2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C29H31F3N6O4/c1-17-14-23(39)37(36-25(17)20-10-11-24(41-4)38-21(20)16-22(35-38)29(30,31)32)12-5-6-13-42-19-9-7-8-18(15-19)26-28(2,3)27(40)34-33-26/h7-11,15-17H,5-6,12-14H2,1-4H3,(H,34,40)
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n/an/a 0.0640n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE4B (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50428575
PNG
(CHEMBL2337960)
Show SMILES COc1ccc(C2=NN(CCCCOc3ccc(cc3)C3=NNC(=O)CC3)C(=O)CC2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C28H29F3N6O4/c1-17-15-25(39)36(13-3-4-14-41-19-7-5-18(6-8-19)21-10-11-24(38)33-32-21)35-27(17)20-9-12-26(40-2)37-22(20)16-23(34-37)28(29,30)31/h5-9,12,16-17H,3-4,10-11,13-15H2,1-2H3,(H,33,38)
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n/an/a 0.100n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE4B (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50428579
PNG
(CHEMBL2337976)
Show SMILES COc1ccc(C2=NN(CCCCCOc3ccc(cc3)C3=NNC(=O)CC3C)C(=O)CC2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C30H33F3N6O4/c1-18-15-25(40)34-35-28(18)20-7-9-21(10-8-20)43-14-6-4-5-13-38-26(41)16-19(2)29(37-38)22-11-12-27(42-3)39-23(22)17-24(36-39)30(31,32)33/h7-12,17-19H,4-6,13-16H2,1-3H3,(H,34,40)
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n/an/a 0.200n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE4B (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
Phosphodiesterase 3 (PDE3)


(Homo sapiens (human))
BDBM50428590
PNG
(CHEMBL2337969)
Show SMILES CCc1cc2c(ccc(OC)n2n1)C1=NN(CCCCOc2ccc(cc2)C2=NNC(=O)CC2C)C(=O)CC1
Show InChI InChI=1S/C29H34N6O4/c1-4-21-18-25-23(11-14-28(38-3)35(25)32-21)24-12-13-27(37)34(33-24)15-5-6-16-39-22-9-7-20(8-10-22)29-19(2)17-26(36)30-31-29/h7-11,14,18-19H,4-6,12-13,15-17H2,1-3H3,(H,30,36)
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n/an/a 0.270n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE3A (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50428593
PNG
(CHEMBL2337966)
Show SMILES COc1ccc(C2=NN(CCCCOc3ccc(C4=NNC(=O)C4(C)C)c(F)c3)C(=O)CC2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C29H30F4N6O4/c1-16-13-23(40)38(37-25(16)19-9-10-24(42-4)39-21(19)15-22(36-39)29(31,32)33)11-5-6-12-43-17-7-8-18(20(30)14-17)26-28(2,3)27(41)35-34-26/h7-10,14-16H,5-6,11-13H2,1-4H3,(H,35,41)
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n/an/a 0.300n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE4B (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50428580
PNG
(CHEMBL2337958)
Show SMILES COc1ccc(C2=NN(CCCCOc3ccc(cc3)C3=NNC(=O)CC3C)C(=O)CC2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C29H31F3N6O4/c1-17-14-24(39)33-34-27(17)19-6-8-20(9-7-19)42-13-5-4-12-37-25(40)15-18(2)28(36-37)21-10-11-26(41-3)38-22(21)16-23(35-38)29(30,31)32/h6-11,16-18H,4-5,12-15H2,1-3H3,(H,33,39)
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n/an/a 0.300n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE4B (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50428584
PNG
(CHEMBL2337975)
Show SMILES COc1ccc(C2=NN(CCCCOc3ccc(C4=NNC(=O)C4(C)C)c(F)c3F)C(=O)C2(C)C)c2sc(nc12)C(F)(F)F
Show InChI InChI=1S/C29H28F5N5O4S/c1-27(2)22(36-37-24(27)40)14-8-10-16(19(31)18(14)30)43-13-7-6-12-39-26(41)28(3,4)23(38-39)15-9-11-17(42-5)20-21(15)44-25(35-20)29(32,33)34/h8-11H,6-7,12-13H2,1-5H3,(H,37,40)
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n/an/a 0.380n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE4B (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50428572
PNG
(CHEMBL2337963)
Show SMILES COc1ccc(C2=NN(CCCCOc3cccc(c3)C3=NNC(=O)CC3C)C(=O)CC2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C29H31F3N6O4/c1-17-13-24(39)33-34-27(17)19-7-6-8-20(15-19)42-12-5-4-11-37-25(40)14-18(2)28(36-37)21-9-10-26(41-3)38-22(21)16-23(35-38)29(30,31)32/h6-10,15-18H,4-5,11-14H2,1-3H3,(H,33,39)
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n/an/a 0.5n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE4B (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50428573
PNG
(CHEMBL2337962)
Show SMILES COc1ccc(C2=NN(CCCCOc3ccc(cc3)C3=NNC(=O)C3(C)C)C(=O)CC2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C29H31F3N6O4/c1-17-15-23(39)37(36-25(17)20-11-12-24(41-4)38-21(20)16-22(35-38)29(30,31)32)13-5-6-14-42-19-9-7-18(8-10-19)26-28(2,3)27(40)34-33-26/h7-12,16-17H,5-6,13-15H2,1-4H3,(H,34,40)
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Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE4B (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50428588
PNG
(CHEMBL2337971)
Show SMILES CCc1cc2c(ccc(OC)n2n1)C1=NN(CCCCOc2ccc(cc2)C2=NNC(=O)CC2C)C(=O)C1(C)C
Show InChI InChI=1S/C30H36N6O4/c1-6-21-18-24-23(13-14-26(39-5)36(24)33-21)28-30(3,4)29(38)35(34-28)15-7-8-16-40-22-11-9-20(10-12-22)27-19(2)17-25(37)31-32-27/h9-14,18-19H,6-8,15-17H2,1-5H3,(H,31,37)
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n/an/a 0.600n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE4B (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50428582
PNG
(CHEMBL2337956)
Show SMILES COc1ccc(C2=NN(CCOc3ccc(cc3)C3=NNC(=O)CC3C)C(=O)CC2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C27H27F3N6O4/c1-15-12-22(37)31-32-25(15)17-4-6-18(7-5-17)40-11-10-35-23(38)13-16(2)26(34-35)19-8-9-24(39-3)36-20(19)14-21(33-36)27(28,29)30/h4-9,14-16H,10-13H2,1-3H3,(H,31,37)
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n/an/a 0.660n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE4B (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50428586
PNG
(CHEMBL2337973)
Show SMILES COc1ccc(C2=NN(CCCCOc3ccc(C4=NNC(=O)CC4)c(F)c3F)C(=O)C2(C)C)c2sc(nc12)C(F)(F)F
Show InChI InChI=1S/C28H26F5N5O4S/c1-27(2)24(15-7-10-18(41-3)22-23(15)43-25(34-22)28(31,32)33)37-38(26(27)40)12-4-5-13-42-17-9-6-14(20(29)21(17)30)16-8-11-19(39)36-35-16/h6-7,9-10H,4-5,8,11-13H2,1-3H3,(H,36,39)
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n/an/a 0.770n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE4B (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
Phosphodiesterase 3 (PDE3)


(Homo sapiens (human))
BDBM50428577
PNG
(CHEMBL2337953)
Show SMILES CCc1cc2c(ccc(OC)n2n1)C1=NN(CCCCOc2ccc(cc2)C2=NNC(=O)CC2C)C(=O)CC1C
Show InChI InChI=1S/C30H36N6O4/c1-5-22-18-25-24(12-13-28(39-4)36(25)33-22)30-20(3)17-27(38)35(34-30)14-6-7-15-40-23-10-8-21(9-11-23)29-19(2)16-26(37)31-32-29/h8-13,18-20H,5-7,14-17H2,1-4H3,(H,31,37)
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Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE3A (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50428570
PNG
(CHEMBL2337965)
Show SMILES COc1ccc(C2=NN(CCCCOc3ccc(cc3F)C3=NNC(=O)C3(C)C)C(=O)CC2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C29H30F4N6O4/c1-16-13-23(40)38(37-25(16)18-8-10-24(42-4)39-20(18)15-22(36-39)29(31,32)33)11-5-6-12-43-21-9-7-17(14-19(21)30)26-28(2,3)27(41)35-34-26/h7-10,14-16H,5-6,11-13H2,1-4H3,(H,35,41)
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Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE4B (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
Phosphodiesterase 3 (PDE3)


(Homo sapiens (human))
BDBM50428588
PNG
(CHEMBL2337971)
Show SMILES CCc1cc2c(ccc(OC)n2n1)C1=NN(CCCCOc2ccc(cc2)C2=NNC(=O)CC2C)C(=O)C1(C)C
Show InChI InChI=1S/C30H36N6O4/c1-6-21-18-24-23(13-14-26(39-5)36(24)33-21)28-30(3,4)29(38)35(34-28)15-7-8-16-40-22-11-9-20(10-12-22)27-19(2)17-25(37)31-32-27/h9-14,18-19H,6-8,15-17H2,1-5H3,(H,31,37)
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Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE3A (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50428577
PNG
(CHEMBL2337953)
Show SMILES CCc1cc2c(ccc(OC)n2n1)C1=NN(CCCCOc2ccc(cc2)C2=NNC(=O)CC2C)C(=O)CC1C
Show InChI InChI=1S/C30H36N6O4/c1-5-22-18-25-24(12-13-28(39-4)36(25)33-22)30-20(3)17-27(38)35(34-30)14-6-7-15-40-23-10-8-21(9-11-23)29-19(2)16-26(37)31-32-29/h8-13,18-20H,5-7,14-17H2,1-4H3,(H,31,37)
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Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE4B (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50428591
PNG
(CHEMBL2337968)
Show SMILES COc1ccc(C2=NN(CCCCOc3ccc(C4=NNC(=O)CC4)c(F)c3F)C(=O)CC2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C28H27F5N6O4/c1-15-13-23(41)38(37-27(15)17-6-10-24(42-2)39-19(17)14-21(36-39)28(31,32)33)11-3-4-12-43-20-8-5-16(25(29)26(20)30)18-7-9-22(40)35-34-18/h5-6,8,10,14-15H,3-4,7,9,11-13H2,1-2H3,(H,35,40)
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Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE4B (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50428590
PNG
(CHEMBL2337969)
Show SMILES CCc1cc2c(ccc(OC)n2n1)C1=NN(CCCCOc2ccc(cc2)C2=NNC(=O)CC2C)C(=O)CC1
Show InChI InChI=1S/C29H34N6O4/c1-4-21-18-25-23(11-14-28(38-3)35(25)32-21)24-12-13-27(37)34(33-24)15-5-6-16-39-22-9-7-20(8-10-22)29-19(2)17-26(36)30-31-29/h7-11,14,18-19H,4-6,12-13,15-17H2,1-3H3,(H,30,36)
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Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE4B (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
Phosphodiesterase 3 (PDE3)


(Homo sapiens (human))
BDBM50428589
PNG
(CHEMBL2337970)
Show SMILES CCc1cc2c(ccc(OC)n2n1)-c1ccc(=O)n(CCCCOc2ccc(cc2)C2=NNC(=O)CC2C)n1
Show InChI InChI=1S/C29H32N6O4/c1-4-21-18-25-23(11-14-28(38-3)35(25)32-21)24-12-13-27(37)34(33-24)15-5-6-16-39-22-9-7-20(8-10-22)29-19(2)17-26(36)30-31-29/h7-14,18-19H,4-6,15-17H2,1-3H3,(H,30,36)
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Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE3A (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50428581
PNG
(CHEMBL2337957)
Show SMILES COc1ccc(C2=NN(CCCOc3ccc(cc3)C3=NNC(=O)CC3C)C(=O)CC2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C28H29F3N6O4/c1-16-13-23(38)32-33-26(16)18-5-7-19(8-6-18)41-12-4-11-36-24(39)14-17(2)27(35-36)20-9-10-25(40-3)37-21(20)15-22(34-37)28(29,30)31/h5-10,15-17H,4,11-14H2,1-3H3,(H,32,38)
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n/an/a 3n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE4B (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50428592
PNG
(CHEMBL2337967)
Show SMILES COc1ccc(C2=NN(CCCCOc3ccc(C4=NNC(=O)C4(C)C)c(F)c3F)C(=O)CC2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C29H29F5N6O4/c1-15-13-21(41)39(38-25(15)16-8-10-22(43-4)40-18(16)14-20(37-40)29(32,33)34)11-5-6-12-44-19-9-7-17(23(30)24(19)31)26-28(2,3)27(42)36-35-26/h7-10,14-15H,5-6,11-13H2,1-4H3,(H,36,42)
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n/an/a 3.10n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE4B (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50428585
PNG
(CHEMBL2337974)
Show SMILES COc1ccc(C2=NN(CCCCOc3ccc(C4=NNC(=O)C4(C)C)c(F)c3F)C(=O)C2(C)C)n2cc(nc12)C(F)(F)F
Show InChI InChI=1S/C29H29F5N6O4/c1-27(2)22(36-37-25(27)41)15-8-10-17(21(31)20(15)30)44-13-7-6-12-40-26(42)28(3,4)23(38-40)16-9-11-18(43-5)24-35-19(14-39(16)24)29(32,33)34/h8-11,14H,6-7,12-13H2,1-5H3,(H,37,41)
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n/an/a 3.20n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE4B (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
Phosphodiesterase 3 (PDE3)


(Homo sapiens (human))
BDBM50428587
PNG
(CHEMBL2337972)
Show SMILES COc1ccc(C2=NN(CCCCOc3ccc(C4=NNC(=O)CC4)c(F)c3F)C(=O)C2(C)C)n2cc(nc12)C(F)(F)F
Show InChI InChI=1S/C28H27F5N6O4/c1-27(2)24(17-8-10-19(42-3)25-34-20(14-38(17)25)28(31,32)33)37-39(26(27)41)12-4-5-13-43-18-9-6-15(22(29)23(18)30)16-7-11-21(40)36-35-16/h6,8-10,14H,4-5,7,11-13H2,1-3H3,(H,36,40)
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n/an/a 5n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE3A (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
Phosphodiesterase 3 (PDE3)


(Homo sapiens (human))
BDBM50428591
PNG
(CHEMBL2337968)
Show SMILES COc1ccc(C2=NN(CCCCOc3ccc(C4=NNC(=O)CC4)c(F)c3F)C(=O)CC2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C28H27F5N6O4/c1-15-13-23(41)38(37-27(15)17-6-10-24(42-2)39-19(17)14-21(36-39)28(31,32)33)11-3-4-12-43-20-8-5-16(25(29)26(20)30)18-7-9-22(40)35-34-18/h5-6,8,10,14-15H,3-4,7,9,11-13H2,1-2H3,(H,35,40)
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Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE3A (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50428578
PNG
(CHEMBL2337954)
Show SMILES CCc1cc2c(ccc(OC)n2n1)C1=NN(CCCOc2ccc(cc2)C2=NNC(=O)CC2C)C(=O)CC1C
Show InChI InChI=1S/C29H34N6O4/c1-5-21-17-24-23(11-12-27(38-4)35(24)32-21)29-19(3)16-26(37)34(33-29)13-6-14-39-22-9-7-20(8-10-22)28-18(2)15-25(36)30-31-28/h7-12,17-19H,5-6,13-16H2,1-4H3,(H,30,36)
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Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE4B (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50428576
PNG
(CHEMBL2337959)
Show SMILES COc1ccc(C2=NN(CCCCOc3ccc(cc3)-c3n[nH]c(=O)cc3C)C(=O)CC2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C29H29F3N6O4/c1-17-14-24(39)33-34-27(17)19-6-8-20(9-7-19)42-13-5-4-12-37-25(40)15-18(2)28(36-37)21-10-11-26(41-3)38-22(21)16-23(35-38)29(30,31)32/h6-11,14,16,18H,4-5,12-13,15H2,1-3H3,(H,33,39)
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n/an/a 6n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE4B (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50428587
PNG
(CHEMBL2337972)
Show SMILES COc1ccc(C2=NN(CCCCOc3ccc(C4=NNC(=O)CC4)c(F)c3F)C(=O)C2(C)C)n2cc(nc12)C(F)(F)F
Show InChI InChI=1S/C28H27F5N6O4/c1-27(2)24(17-8-10-19(42-3)25-34-20(14-38(17)25)28(31,32)33)37-39(26(27)41)12-4-5-13-43-18-9-6-15(22(29)23(18)30)16-7-11-21(40)36-35-16/h6,8-10,14H,4-5,7,11-13H2,1-3H3,(H,36,40)
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n/an/a 6.70n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE4B (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
Phosphodiesterase 3 (PDE3)


(Homo sapiens (human))
BDBM50428586
PNG
(CHEMBL2337973)
Show SMILES COc1ccc(C2=NN(CCCCOc3ccc(C4=NNC(=O)CC4)c(F)c3F)C(=O)C2(C)C)c2sc(nc12)C(F)(F)F
Show InChI InChI=1S/C28H26F5N5O4S/c1-27(2)24(15-7-10-18(41-3)22-23(15)43-25(34-22)28(31,32)33)37-38(26(27)40)12-4-5-13-42-17-9-6-14(20(29)21(17)30)16-8-11-19(39)36-35-16/h6-7,9-10H,4-5,8,11-13H2,1-3H3,(H,36,39)
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Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE3A (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
Phosphodiesterase 3 (PDE3)


(Homo sapiens (human))
BDBM50428578
PNG
(CHEMBL2337954)
Show SMILES CCc1cc2c(ccc(OC)n2n1)C1=NN(CCCOc2ccc(cc2)C2=NNC(=O)CC2C)C(=O)CC1C
Show InChI InChI=1S/C29H34N6O4/c1-5-21-17-24-23(11-12-27(38-4)35(24)32-21)29-19(3)16-26(37)34(33-29)13-6-14-39-22-9-7-20(8-10-22)28-18(2)15-25(36)30-31-28/h7-12,17-19H,5-6,13-16H2,1-4H3,(H,30,36)
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n/an/a 11n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE3A (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
Phosphodiesterase 3 (PDE3)


(Homo sapiens (human))
BDBM50428592
PNG
(CHEMBL2337967)
Show SMILES COc1ccc(C2=NN(CCCCOc3ccc(C4=NNC(=O)C4(C)C)c(F)c3F)C(=O)CC2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C29H29F5N6O4/c1-15-13-21(41)39(38-25(15)16-8-10-22(43-4)40-18(16)14-20(37-40)29(32,33)34)11-5-6-12-44-19-9-7-17(23(30)24(19)31)26-28(2,3)27(42)36-35-26/h7-10,14-15H,5-6,11-13H2,1-4H3,(H,36,42)
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Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE3A (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
Phosphodiesterase 3 (PDE3)


(Homo sapiens (human))
BDBM50428580
PNG
(CHEMBL2337958)
Show SMILES COc1ccc(C2=NN(CCCCOc3ccc(cc3)C3=NNC(=O)CC3C)C(=O)CC2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C29H31F3N6O4/c1-17-14-24(39)33-34-27(17)19-6-8-20(9-7-19)42-13-5-4-12-37-25(40)15-18(2)28(36-37)21-10-11-26(41-3)38-22(21)16-23(35-38)29(30,31)32/h6-11,16-18H,4-5,12-15H2,1-3H3,(H,33,39)
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n/an/a 15n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE3A (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50428589
PNG
(CHEMBL2337970)
Show SMILES CCc1cc2c(ccc(OC)n2n1)-c1ccc(=O)n(CCCCOc2ccc(cc2)C2=NNC(=O)CC2C)n1
Show InChI InChI=1S/C29H32N6O4/c1-4-21-18-25-23(11-14-28(38-3)35(25)32-21)24-12-13-27(37)34(33-24)15-5-6-16-39-22-9-7-20(8-10-22)29-19(2)17-26(36)30-31-29/h7-14,18-19H,4-6,15-17H2,1-3H3,(H,30,36)
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Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE4B (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50428574
PNG
(CHEMBL2337961)
Show SMILES COc1ccc(C2=NN(CCCCOc3ccc(cc3)-c3ccc(=O)[nH]n3)C(=O)CC2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C28H27F3N6O4/c1-17-15-25(39)36(13-3-4-14-41-19-7-5-18(6-8-19)21-10-11-24(38)33-32-21)35-27(17)20-9-12-26(40-2)37-22(20)16-23(34-37)28(29,30)31/h5-12,16-17H,3-4,13-15H2,1-2H3,(H,33,38)
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Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE4B (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
Phosphodiesterase 3 (PDE3)


(Homo sapiens (human))
BDBM50428585
PNG
(CHEMBL2337974)
Show SMILES COc1ccc(C2=NN(CCCCOc3ccc(C4=NNC(=O)C4(C)C)c(F)c3F)C(=O)C2(C)C)n2cc(nc12)C(F)(F)F
Show InChI InChI=1S/C29H29F5N6O4/c1-27(2)22(36-37-25(27)41)15-8-10-17(21(31)20(15)30)44-13-7-6-12-40-26(42)28(3,4)23(38-40)16-9-11-18(43-5)24-35-19(14-39(16)24)29(32,33)34/h8-11,14H,6-7,12-13H2,1-5H3,(H,37,41)
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Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE3A (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50428583
PNG
(CHEMBL2337955)
Show SMILES COc1ccc(C2=NNC(=O)C[C@@H]2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C14H13F3N4O2/c1-7-5-11(22)18-19-13(7)8-3-4-12(23-2)21-9(8)6-10(20-21)14(15,16)17/h3-4,6-7H,5H2,1-2H3,(H,18,22)/t7-/m0/s1
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n/an/a 42n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE4B (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
Phosphodiesterase 3 (PDE3)


(Homo sapiens (human))
BDBM50428593
PNG
(CHEMBL2337966)
Show SMILES COc1ccc(C2=NN(CCCCOc3ccc(C4=NNC(=O)C4(C)C)c(F)c3)C(=O)CC2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C29H30F4N6O4/c1-16-13-23(40)38(37-25(16)19-9-10-24(42-4)39-21(19)15-22(36-39)29(31,32)33)11-5-6-12-43-17-7-8-18(20(30)14-17)26-28(2,3)27(41)35-34-26/h7-10,14-16H,5-6,11-13H2,1-4H3,(H,35,41)
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n/an/a 58n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE3A (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
Phosphodiesterase 3 (PDE3)


(Homo sapiens (human))
BDBM50428584
PNG
(CHEMBL2337975)
Show SMILES COc1ccc(C2=NN(CCCCOc3ccc(C4=NNC(=O)C4(C)C)c(F)c3F)C(=O)C2(C)C)c2sc(nc12)C(F)(F)F
Show InChI InChI=1S/C29H28F5N5O4S/c1-27(2)22(36-37-24(27)40)14-8-10-16(19(31)18(14)30)43-13-7-6-12-39-26(41)28(3,4)23(38-39)15-9-11-17(42-5)20-21(15)44-25(35-20)29(32,33)34/h8-11H,6-7,12-13H2,1-5H3,(H,37,40)
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n/an/a 63n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE3A (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4B


(Homo sapiens (Human))
BDBM50390629
PNG
(CHEMBL2069600)
Show SMILES COc1ccc(C2=NNC(=O)CC2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C14H13F3N4O2/c1-7-5-11(22)18-19-13(7)8-3-4-12(23-2)21-9(8)6-10(20-21)14(15,16)17/h3-4,6-7H,5H2,1-2H3,(H,18,22)
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n/an/a 70n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE4B (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
Phosphodiesterase 3 (PDE3)


(Homo sapiens (human))
BDBM50428579
PNG
(CHEMBL2337976)
Show SMILES COc1ccc(C2=NN(CCCCCOc3ccc(cc3)C3=NNC(=O)CC3C)C(=O)CC2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C30H33F3N6O4/c1-18-15-25(40)34-35-28(18)20-7-9-21(10-8-20)43-14-6-4-5-13-38-26(41)16-19(2)29(37-38)22-11-12-27(42-3)39-23(22)17-24(36-39)30(31,32)33/h7-12,17-19H,4-6,13-16H2,1-3H3,(H,34,40)
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n/an/a 72n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE3A (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
Phosphodiesterase 3 (PDE3)


(Homo sapiens (human))
BDBM50428582
PNG
(CHEMBL2337956)
Show SMILES COc1ccc(C2=NN(CCOc3ccc(cc3)C3=NNC(=O)CC3C)C(=O)CC2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C27H27F3N6O4/c1-15-12-22(37)31-32-25(15)17-4-6-18(7-5-17)40-11-10-35-23(38)13-16(2)26(34-35)19-8-9-24(39-3)36-20(19)14-21(33-36)27(28,29)30/h4-9,14-16H,10-13H2,1-3H3,(H,31,37)
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n/an/a 130n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE3A (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
Phosphodiesterase 3 (PDE3)


(Homo sapiens (human))
BDBM50428581
PNG
(CHEMBL2337957)
Show SMILES COc1ccc(C2=NN(CCCOc3ccc(cc3)C3=NNC(=O)CC3C)C(=O)CC2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C28H29F3N6O4/c1-16-13-23(38)32-33-26(16)18-5-7-19(8-6-18)41-12-4-11-36-24(39)14-17(2)27(35-36)20-9-10-25(40-3)37-21(20)15-22(34-37)28(29,30)31/h5-10,15-17H,4,11-14H2,1-3H3,(H,32,38)
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n/an/a 140n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE3A (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
Phosphodiesterase 3 (PDE3)


(Homo sapiens (human))
BDBM50428573
PNG
(CHEMBL2337962)
Show SMILES COc1ccc(C2=NN(CCCCOc3ccc(cc3)C3=NNC(=O)C3(C)C)C(=O)CC2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C29H31F3N6O4/c1-17-15-23(39)37(36-25(17)20-11-12-24(41-4)38-21(20)16-22(35-38)29(30,31)32)13-5-6-14-42-19-9-7-18(8-10-19)26-28(2,3)27(40)34-33-26/h7-12,16-17H,5-6,13-15H2,1-4H3,(H,34,40)
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n/an/a 270n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE3A (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
Phosphodiesterase 3 (PDE3)


(Homo sapiens (human))
BDBM50428583
PNG
(CHEMBL2337955)
Show SMILES COc1ccc(C2=NNC(=O)C[C@@H]2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C14H13F3N4O2/c1-7-5-11(22)18-19-13(7)8-3-4-12(23-2)21-9(8)6-10(20-21)14(15,16)17/h3-4,6-7H,5H2,1-2H3,(H,18,22)/t7-/m0/s1
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n/an/a 360n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE3A (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
Phosphodiesterase 3 (PDE3)


(Homo sapiens (human))
BDBM50428575
PNG
(CHEMBL2337960)
Show SMILES COc1ccc(C2=NN(CCCCOc3ccc(cc3)C3=NNC(=O)CC3)C(=O)CC2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C28H29F3N6O4/c1-17-15-25(39)36(13-3-4-14-41-19-7-5-18(6-8-19)21-10-11-24(38)33-32-21)35-27(17)20-9-12-26(40-2)37-22(20)16-23(34-37)28(29,30)31/h5-9,12,16-17H,3-4,10-11,13-15H2,1-2H3,(H,33,38)
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n/an/a 360n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE3A (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
Phosphodiesterase 3 (PDE3)


(Homo sapiens (human))
BDBM50428572
PNG
(CHEMBL2337963)
Show SMILES COc1ccc(C2=NN(CCCCOc3cccc(c3)C3=NNC(=O)CC3C)C(=O)CC2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C29H31F3N6O4/c1-17-13-24(39)33-34-27(17)19-7-6-8-20(15-19)42-12-5-4-11-37-25(40)14-18(2)28(36-37)21-9-10-26(41-3)38-22(21)16-23(35-38)29(30,31)32/h6-10,15-18H,4-5,11-14H2,1-3H3,(H,33,39)
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n/an/a 590n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE3A (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
Phosphodiesterase 3 (PDE3)


(Homo sapiens (human))
BDBM50428570
PNG
(CHEMBL2337965)
Show SMILES COc1ccc(C2=NN(CCCCOc3ccc(cc3F)C3=NNC(=O)C3(C)C)C(=O)CC2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C29H30F4N6O4/c1-16-13-23(40)38(37-25(16)18-8-10-24(42-4)39-20(18)15-22(36-39)29(31,32)33)11-5-6-12-43-21-9-7-17(14-19(21)30)26-28(2,3)27(41)35-34-26/h7-10,14-16H,5-6,11-13H2,1-4H3,(H,35,41)
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n/an/a 1.52E+3n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE3A (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
Phosphodiesterase 3 (PDE3)


(Homo sapiens (human))
BDBM50428571
PNG
(CHEMBL2337964)
Show SMILES COc1ccc(C2=NN(CCCCOc3cccc(c3)C3=NNC(=O)C3(C)C)C(=O)CC2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C29H31F3N6O4/c1-17-14-23(39)37(36-25(17)20-10-11-24(41-4)38-21(20)16-22(35-38)29(30,31)32)12-5-6-13-42-19-9-7-8-18(15-19)26-28(2,3)27(40)34-33-26/h7-11,15-17H,5-6,12-14H2,1-4H3,(H,34,40)
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n/an/a 1.73E+3n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE3A (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
Phosphodiesterase 3 (PDE3)


(Homo sapiens (human))
BDBM50390629
PNG
(CHEMBL2069600)
Show SMILES COc1ccc(C2=NNC(=O)CC2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C14H13F3N4O2/c1-7-5-11(22)18-19-13(7)8-3-4-12(23-2)21-9(8)6-10(20-21)14(15,16)17/h3-4,6-7H,5H2,1-2H3,(H,18,22)
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n/an/a 2.38E+3n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE3A (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
Phosphodiesterase 3 (PDE3)


(Homo sapiens (human))
BDBM50428574
PNG
(CHEMBL2337961)
Show SMILES COc1ccc(C2=NN(CCCCOc3ccc(cc3)-c3ccc(=O)[nH]n3)C(=O)CC2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C28H27F3N6O4/c1-17-15-25(39)36(13-3-4-14-41-19-7-5-18(6-8-19)21-10-11-24(38)33-32-21)35-27(17)20-9-12-26(40-2)37-22(20)16-23(34-37)28(29,30)31/h5-12,16-17H,3-4,13-15H2,1-2H3,(H,33,38)
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n/an/a 3.80E+4n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE3A (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
Phosphodiesterase 3 (PDE3)


(Homo sapiens (human))
BDBM50428576
PNG
(CHEMBL2337959)
Show SMILES COc1ccc(C2=NN(CCCCOc3ccc(cc3)-c3n[nH]c(=O)cc3C)C(=O)CC2C)c2cc(nn12)C(F)(F)F
Show InChI InChI=1S/C29H29F3N6O4/c1-17-14-24(39)33-34-27(17)19-6-8-20(9-7-19)42-13-5-4-12-37-25(40)15-18(2)28(36-37)21-10-11-26(41-3)38-22(21)16-23(35-38)29(30,31)32/h6-11,14,16,18H,4-5,12-13,15H2,1-3H3,(H,33,39)
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n/an/a 4.00E+4n/an/an/an/an/an/a



Kyorin Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of PDE3A (unknown origin) by radiochemical assay


Bioorg Med Chem Lett 23: 375-81 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.121
BindingDB Entry DOI: 10.7270/Q2B27WNB
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%