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PubMed code 19540112

Compile data set for download or QSAR
Found 33 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
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297795
PNG
(4-(cyclohexylmethyl)-6-(6-methoxypyridin-3-yl)-2-(...)
Show SMILES COc1ccc(cn1)-c1ccc2nc(NCC3CCOCC3)c(=O)n(CC3CCCCC3)c2n1
Show InChI InChI=1S/C26H33N5O3/c1-33-23-10-7-20(16-27-23)21-8-9-22-25(30-21)31(17-19-5-3-2-4-6-19)26(32)24(29-22)28-15-18-11-13-34-14-12-18/h7-10,16,18-19H,2-6,11-15,17H2,1H3,(H,28,29)
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n/an/a 0.300n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297794
PNG
(2-(4-(cyclohexylmethyl)-6-(6-methoxypyridin-3-yl)-...)
Show SMILES COc1ccc(cn1)-c1ccc2nc(NCC(=O)N(C)C)c(=O)n(CC3CCCCC3)c2n1
Show InChI InChI=1S/C24H30N6O3/c1-29(2)21(31)14-26-22-24(32)30(15-16-7-5-4-6-8-16)23-19(27-22)11-10-18(28-23)17-9-12-20(33-3)25-13-17/h9-13,16H,4-8,14-15H2,1-3H3,(H,26,27)
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n/an/a 0.300n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297796
PNG
(4-(cyclohexylmethyl)-6-(2-methoxypyrimidin-5-yl)-2...)
Show SMILES COc1ncc(cn1)-c1ccc2nc(NCC3CCOCC3)c(=O)n(CC3CCCCC3)c2n1
Show InChI InChI=1S/C25H32N6O3/c1-33-25-27-14-19(15-28-25)20-7-8-21-23(30-20)31(16-18-5-3-2-4-6-18)24(32)22(29-21)26-13-17-9-11-34-12-10-17/h7-8,14-15,17-18H,2-6,9-13,16H2,1H3,(H,26,29)
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n/an/a 0.300n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297797
PNG
(4-(cyclohexylmethyl)-6-(6-methoxypyridin-3-yl)-2-(...)
Show SMILES COc1ccc(cn1)-c1ccc2nc(NCCN3CCOCC3)c(=O)n(CC3CCCCC3)c2n1
Show InChI InChI=1S/C26H34N6O3/c1-34-23-10-7-20(17-28-23)21-8-9-22-25(30-21)32(18-19-5-3-2-4-6-19)26(33)24(29-22)27-11-12-31-13-15-35-16-14-31/h7-10,17,19H,2-6,11-16,18H2,1H3,(H,27,29)
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n/an/a 0.400n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297798
PNG
(4-(cyclohexylmethyl)-6-(pyridin-4-yl)-2-((tetrahyd...)
Show SMILES O=c1c(NCC2CCOCC2)nc2ccc(nc2n1CC1CCCCC1)-c1ccncc1
Show InChI InChI=1S/C25H31N5O2/c31-25-23(27-16-18-10-14-32-15-11-18)28-22-7-6-21(20-8-12-26-13-9-20)29-24(22)30(25)17-19-4-2-1-3-5-19/h6-9,12-13,18-19H,1-5,10-11,14-17H2,(H,27,28)
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n/an/a 0.900n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297799
PNG
(4-(cyclohexylmethyl)-6-(3,5-dimethylisoxazol-4-yl)...)
Show SMILES Cc1noc(C)c1-c1ccc2nc(NCCN3CCOCC3)c(=O)n(CC3CCCCC3)c2n1
Show InChI InChI=1S/C25H34N6O3/c1-17-22(18(2)34-29-17)20-8-9-21-24(28-20)31(16-19-6-4-3-5-7-19)25(32)23(27-21)26-10-11-30-12-14-33-15-13-30/h8-9,19H,3-7,10-16H2,1-2H3,(H,26,27)
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n/an/a 1n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297800
PNG
(6-(4-fluorophenyl)-4-(4-methoxybenzyl)-2-(2-morpho...)
Show SMILES COc1ccc(Cn2c3nc(ccc3nc(NCCN3CCOCC3)c2=O)-c2ccc(F)cc2)cc1
Show InChI InChI=1S/C27H28FN5O3/c1-35-22-8-2-19(3-9-22)18-33-26-24(11-10-23(31-26)20-4-6-21(28)7-5-20)30-25(27(33)34)29-12-13-32-14-16-36-17-15-32/h2-11H,12-18H2,1H3,(H,29,30)
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n/an/a 1.30n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297801
PNG
(4-(cyclohexylmethyl)-6-(3,4-difluorophenyl)-2-(2-m...)
Show SMILES Fc1ccc(cc1F)-c1ccc2nc(NCCN3CCOCC3)c(=O)n(CC3CCCCC3)c2n1
Show InChI InChI=1S/C26H31F2N5O2/c27-20-7-6-19(16-21(20)28)22-8-9-23-25(31-22)33(17-18-4-2-1-3-5-18)26(34)24(30-23)29-10-11-32-12-14-35-15-13-32/h6-9,16,18H,1-5,10-15,17H2,(H,29,30)
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n/an/a 1.60n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297802
PNG
(6-(3,4-difluorophenyl)-4-(4-methoxybenzyl)-2-(2-mo...)
Show SMILES COc1ccc(Cn2c3nc(ccc3nc(NCCN3CCOCC3)c2=O)-c2ccc(F)c(F)c2)cc1
Show InChI InChI=1S/C27H27F2N5O3/c1-36-20-5-2-18(3-6-20)17-34-26-24(9-8-23(32-26)19-4-7-21(28)22(29)16-19)31-25(27(34)35)30-10-11-33-12-14-37-15-13-33/h2-9,16H,10-15,17H2,1H3,(H,30,31)
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n/an/a 2n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297803
PNG
(6-(6-methoxypyridin-3-yl)-4-(2-propoxyethyl)-2-((t...)
Show SMILES CCCOCCn1c2nc(ccc2nc(NCC2CCOCC2)c1=O)-c1ccc(OC)nc1
Show InChI InChI=1S/C24H31N5O4/c1-3-11-32-14-10-29-23-20(6-5-19(28-23)18-4-7-21(31-2)25-16-18)27-22(24(29)30)26-15-17-8-12-33-13-9-17/h4-7,16-17H,3,8-15H2,1-2H3,(H,26,27)
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n/an/a 2.30n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50296252
PNG
(6-(6-methoxypyridin-3-yl)-2-(2-morpholinoethylamin...)
Show SMILES CCCOCCn1c2nc(ccc2nc(NCCN2CCOCC2)c1=O)-c1ccc(OC)nc1
Show InChI InChI=1S/C24H32N6O4/c1-3-13-33-16-12-30-23-20(6-5-19(28-23)18-4-7-21(32-2)26-17-18)27-22(24(30)31)25-8-9-29-10-14-34-15-11-29/h4-7,17H,3,8-16H2,1-2H3,(H,25,27)
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n/an/a 2.40n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297804
PNG
(6-(4-fluorophenyl)-4-(pyridin-3-ylmethyl)-2-((tetr...)
Show SMILES Fc1ccc(cc1)-c1ccc2nc(NCC3CCOCC3)c(=O)n(Cc3cccnc3)c2n1
Show InChI InChI=1S/C25H24FN5O2/c26-20-5-3-19(4-6-20)21-7-8-22-24(30-21)31(16-18-2-1-11-27-14-18)25(32)23(29-22)28-15-17-9-12-33-13-10-17/h1-8,11,14,17H,9-10,12-13,15-16H2,(H,28,29)
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n/an/a 2.5n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297805
PNG
(4-(3,5-difluorobenzyl)-6-(4-fluorophenyl)-2-((tetr...)
Show SMILES Fc1ccc(cc1)-c1ccc2nc(NCC3CCOCC3)c(=O)n(Cc3cc(F)cc(F)c3)c2n1
Show InChI InChI=1S/C26H23F3N4O2/c27-19-3-1-18(2-4-19)22-5-6-23-25(32-22)33(15-17-11-20(28)13-21(29)12-17)26(34)24(31-23)30-14-16-7-9-35-10-8-16/h1-6,11-13,16H,7-10,14-15H2,(H,30,31)
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n/an/a 2.70n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297806
PNG
(4-(cyclohexylmethyl)-6-(6-hydroxypyridin-3-yl)-2-(...)
Show SMILES O=c1ccc(c[nH]1)-c1ccc2nc(NCC3CCOCC3)c(=O)n(CC3CCCCC3)c2n1
Show InChI InChI=1S/C25H31N5O3/c31-22-9-6-19(15-26-22)20-7-8-21-24(29-20)30(16-18-4-2-1-3-5-18)25(32)23(28-21)27-14-17-10-12-33-13-11-17/h6-9,15,17-18H,1-5,10-14,16H2,(H,26,31)(H,27,28)
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n/an/a 2.90n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297807
PNG
(4-(cyclohexylmethyl)-6-(4-fluorophenyl)-2-((tetrah...)
Show SMILES Fc1ccc(cc1)-c1ccc2nc(NCC3CCOCC3)c(=O)n(CC3CCCCC3)c2n1
Show InChI InChI=1S/C26H31FN4O2/c27-21-8-6-20(7-9-21)22-10-11-23-25(30-22)31(17-19-4-2-1-3-5-19)26(32)24(29-23)28-16-18-12-14-33-15-13-18/h6-11,18-19H,1-5,12-17H2,(H,28,29)
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n/an/a 3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297808
PNG
(2-(4-(cyclohexylmethyl)-6-(4-fluorophenyl)-3-oxo-3...)
Show SMILES CN(C)C(=O)CNc1nc2ccc(nc2n(CC2CCCCC2)c1=O)-c1ccc(F)cc1
Show InChI InChI=1S/C24H28FN5O2/c1-29(2)21(31)14-26-22-24(32)30(15-16-6-4-3-5-7-16)23-20(27-22)13-12-19(28-23)17-8-10-18(25)11-9-17/h8-13,16H,3-7,14-15H2,1-2H3,(H,26,27)
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n/an/a 3.5n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297809
PNG
(4-(cyclohexylmethyl)-6-(4-fluorophenyl)-2-(2-morph...)
Show SMILES Fc1ccc(cc1)-c1ccc2nc(NCCN3CCOCC3)c(=O)n(CC3CCCCC3)c2n1
Show InChI InChI=1S/C26H32FN5O2/c27-21-8-6-20(7-9-21)22-10-11-23-25(30-22)32(18-19-4-2-1-3-5-19)26(33)24(29-23)28-12-13-31-14-16-34-17-15-31/h6-11,19H,1-5,12-18H2,(H,28,29)
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n/an/a 4.60n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297810
PNG
(4-(cyclohexylmethyl)-6-(4-fluorophenyl)-2-(pyridin...)
Show SMILES Fc1ccc(cc1)-c1ccc2nc(NCc3cccnc3)c(=O)n(CC3CCCCC3)c2n1
Show InChI InChI=1S/C26H26FN5O/c27-21-10-8-20(9-11-21)22-12-13-23-25(31-22)32(17-18-5-2-1-3-6-18)26(33)24(30-23)29-16-19-7-4-14-28-15-19/h4,7-15,18H,1-3,5-6,16-17H2,(H,29,30)
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n/an/a 13n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297811
PNG
(2-(6-(6-methoxypyridin-3-yl)-3-oxo-4-(2-propoxyeth...)
Show SMILES CCCOCCn1c2nc(ccc2nc(NCC(=O)N(C)C)c1=O)-c1ccc(OC)nc1
Show InChI InChI=1S/C22H28N6O4/c1-5-11-32-12-10-28-21-17(25-20(22(28)30)24-14-19(29)27(2)3)8-7-16(26-21)15-6-9-18(31-4)23-13-15/h6-9,13H,5,10-12,14H2,1-4H3,(H,24,25)
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n/an/a 15n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297812
PNG
(6-(4-fluorophenyl)-4-(pyridin-2-ylmethyl)-2-((tetr...)
Show SMILES Fc1ccc(cc1)-c1ccc2nc(NCC3CCOCC3)c(=O)n(Cc3ccccn3)c2n1
Show InChI InChI=1S/C25H24FN5O2/c26-19-6-4-18(5-7-19)21-8-9-22-24(30-21)31(16-20-3-1-2-12-27-20)25(32)23(29-22)28-15-17-10-13-33-14-11-17/h1-9,12,17H,10-11,13-16H2,(H,28,29)
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n/an/a 20n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297813
PNG
(6-(4-fluorophenyl)-4-(2-propoxyethyl)-2-((tetrahyd...)
Show SMILES CCCOCCn1c2nc(ccc2nc(NCC2CCOCC2)c1=O)-c1ccc(F)cc1
Show InChI InChI=1S/C24H29FN4O3/c1-2-12-31-15-11-29-23-21(8-7-20(28-23)18-3-5-19(25)6-4-18)27-22(24(29)30)26-16-17-9-13-32-14-10-17/h3-8,17H,2,9-16H2,1H3,(H,26,27)
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n/an/a 22n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297793
PNG
(1-(4-methoxybenzyl)-7-(pyridin-4-yl)quinolin-2(1H)...)
Show SMILES COc1ccc(Cn2c3cc(ccc3ccc2=O)-c2ccncc2)cc1
Show InChI InChI=1S/C22H18N2O2/c1-26-20-7-2-16(3-8-20)15-24-21-14-19(17-10-12-23-13-11-17)5-4-18(21)6-9-22(24)25/h2-14H,15H2,1H3
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n/an/a 25n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297814
PNG
(6-(2-methoxypyrimidin-5-yl)-2-(2-morpholinoethylam...)
Show SMILES CCCOCCn1c2nc(ccc2nc(NCCN2CCOCC2)c1=O)-c1cnc(OC)nc1
Show InChI InChI=1S/C23H31N7O4/c1-3-11-33-14-10-30-21-19(5-4-18(28-21)17-15-25-23(32-2)26-16-17)27-20(22(30)31)24-6-7-29-8-12-34-13-9-29/h4-5,15-16H,3,6-14H2,1-2H3,(H,24,27)
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n/an/a 27n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297815
PNG
(2-amino-4-(cyclohexylmethyl)-6-(4-fluorophenyl)pyr...)
Show SMILES Nc1nc2ccc(nc2n(CC2CCCCC2)c1=O)-c1ccc(F)cc1
Show InChI InChI=1S/C20H21FN4O/c21-15-8-6-14(7-9-15)16-10-11-17-19(24-16)25(20(26)18(22)23-17)12-13-4-2-1-3-5-13/h6-11,13H,1-5,12H2,(H2,22,23)
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n/an/a 29n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297816
PNG
(6-(4-fluorophenyl)-2-(2-morpholinoethylamino)-4-(2...)
Show SMILES CCCOCCn1c2nc(ccc2nc(NCCN2CCOCC2)c1=O)-c1ccc(F)cc1
Show InChI InChI=1S/C24H30FN5O3/c1-2-14-32-17-13-30-23-21(8-7-20(28-23)18-3-5-19(25)6-4-18)27-22(24(30)31)26-9-10-29-11-15-33-16-12-29/h3-8H,2,9-17H2,1H3,(H,26,27)
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n/an/a 33n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297817
PNG
(4-(2-propoxyethyl)-6-(pyridin-4-yl)-2-((tetrahydro...)
Show SMILES CCCOCCn1c2nc(ccc2nc(NCC2CCOCC2)c1=O)-c1ccncc1
Show InChI InChI=1S/C23H29N5O3/c1-2-12-30-15-11-28-22-20(4-3-19(27-22)18-5-9-24-10-6-18)26-21(23(28)29)25-16-17-7-13-31-14-8-17/h3-6,9-10,17H,2,7-8,11-16H2,1H3,(H,25,26)
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n/an/a 34n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297818
PNG
(6-(3,5-dimethylisoxazol-4-yl)-2-(2-morpholinoethyl...)
Show SMILES CCCOCCn1c2nc(ccc2nc(NCCN2CCOCC2)c1=O)-c1c(C)noc1C
Show InChI InChI=1S/C23H32N6O4/c1-4-12-31-15-11-29-22-19(6-5-18(26-22)20-16(2)27-33-17(20)3)25-21(23(29)30)24-7-8-28-9-13-32-14-10-28/h5-6H,4,7-15H2,1-3H3,(H,24,25)
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n/an/a 37n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297792
PNG
(7-(3,4-difluorophenyl)-4-methyl-1-pentyl-3,4-dihyd...)
Show SMILES CCCCCN1C(=O)CN(C)c2ncc(cc12)-c1ccc(F)c(F)c1
Show InChI InChI=1S/C19H21F2N3O/c1-3-4-5-8-24-17-10-14(13-6-7-15(20)16(21)9-13)11-22-19(17)23(2)12-18(24)25/h6-7,9-11H,3-5,8,12H2,1-2H3
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n/an/a 43n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297791
PNG
(5-amino-7-phenyl-1-propyl-1,6-naphthyridin-4(1H)-o...)
Show SMILES CCCn1ccc(=O)c2c(N)nc(cc12)-c1ccccc1
Show InChI InChI=1S/C17H17N3O/c1-2-9-20-10-8-15(21)16-14(20)11-13(19-17(16)18)12-6-4-3-5-7-12/h3-8,10-11H,2,9H2,1H3,(H2,18,19)
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n/an/a 51n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297819
PNG
(6-(3,4-difluorophenyl)-4-(2-isopropoxyethyl)-2-(2-...)
Show SMILES CC(C)OCCn1c2nc(ccc2nc(NCCN2CCOCC2)c1=O)-c1ccc(F)c(F)c1
Show InChI InChI=1S/C24H29F2N5O3/c1-16(2)34-14-11-31-23-21(6-5-20(29-23)17-3-4-18(25)19(26)15-17)28-22(24(31)32)27-7-8-30-9-12-33-13-10-30/h3-6,15-16H,7-14H2,1-2H3,(H,27,28)
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n/an/a 53n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297820
PNG
(4-(2-ethoxyethyl)-6-(4-fluorophenyl)-2-((tetrahydr...)
Show SMILES CCOCCn1c2nc(ccc2nc(NCC2CCOCC2)c1=O)-c1ccc(F)cc1
Show InChI InChI=1S/C23H27FN4O3/c1-2-30-14-11-28-22-20(8-7-19(27-22)17-3-5-18(24)6-4-17)26-21(23(28)29)25-15-16-9-12-31-13-10-16/h3-8,16H,2,9-15H2,1H3,(H,25,26)
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n/an/a 149n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297821
PNG
(6-(4-fluorophenyl)-4-isobutyl-2-((tetrahydro-2H-py...)
Show SMILES CC(C)Cn1c2nc(ccc2nc(NCC2CCOCC2)c1=O)-c1ccc(F)cc1
Show InChI InChI=1S/C23H27FN4O2/c1-15(2)14-28-22-20(8-7-19(27-22)17-3-5-18(24)6-4-17)26-21(23(28)29)25-13-16-9-11-30-12-10-16/h3-8,15-16H,9-14H2,1-2H3,(H,25,26)
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n/an/a 224n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (human))
BDBM50297822
PNG
(6-(6-hydroxypyridin-3-yl)-2-(2-morpholinoethylamin...)
Show SMILES CCCOCCn1c2nc(ccc2nc(NCCN2CCOCC2)c1=O)-c1ccc(=O)[nH]c1
Show InChI InChI=1S/C23H30N6O4/c1-2-12-32-15-11-29-22-19(5-4-18(27-22)17-3-6-20(30)25-16-17)26-21(23(29)31)24-7-8-28-9-13-33-14-10-28/h3-6,16H,2,7-15H2,1H3,(H,24,26)(H,25,30)
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n/an/a 534n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of PDE5


Bioorg Med Chem Lett 19: 4088-91 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.012
BindingDB Entry DOI: 10.7270/Q23R0SXR
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%