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PubMed code 21705115

Compile data set for download or QSAR
Found 37 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 and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Rattus norvegicus (rat))
BDBM31592
PNG
(PF-2545920 | US9138494, MP-10 | substituted pyraz...)
Show SMILES Cn1cc(c(n1)-c1ccc(OCc2ccc3ccccc3n2)cc1)-c1ccncc1
Show InChI InChI=1S/C25H20N4O/c1-29-16-23(18-12-14-26-15-13-18)25(28-29)20-7-10-22(11-8-20)30-17-21-9-6-19-4-2-3-5-24(19)27-21/h2-16H,17H2,1H3
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n/an/a 0.180n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of rat PDE10A


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Rattus norvegicus (rat))
BDBM31596
PNG
(substituted pyrazole, 13)
Show SMILES FC(F)(F)Cn1cc(c(n1)-c1ccc(OCc2ccc3ccccc3n2)cc1)-c1ccncc1
Show InChI InChI=1S/C26H19F3N4O/c27-26(28,29)17-33-15-23(18-11-13-30-14-12-18)25(32-33)20-6-9-22(10-7-20)34-16-21-8-5-19-3-1-2-4-24(19)31-21/h1-15H,16-17H2
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n/an/a 0.300n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of rat PDE10A


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Rattus norvegicus (rat))
BDBM50351893
PNG
(CHEMBL1825071)
Show SMILES COc1cc2ncnc(C3CC[C@@H](C3)Oc3cnc4ccccc4n3)c2cc1OC |r|
Show InChI InChI=1S/C23H22N4O3/c1-28-20-10-16-19(11-21(20)29-2)25-13-26-23(16)14-7-8-15(9-14)30-22-12-24-17-5-3-4-6-18(17)27-22/h3-6,10-15H,7-9H2,1-2H3/t14?,15-/m0/s1
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n/an/a 6n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of rat PDE10A


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))
BDBM14754
PNG
(1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-isoq...)
Show SMILES COc1ccc(Cc2nccc3cc(OC)c(OC)cc23)cc1OC
Show InChI InChI=1S/C20H21NO4/c1-22-17-6-5-13(10-18(17)23-2)9-16-15-12-20(25-4)19(24-3)11-14(15)7-8-21-16/h5-8,10-12H,9H2,1-4H3
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n/an/a 21n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE10A assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))
BDBM50351891
PNG
(CHEMBL1821790)
Show SMILES COc1cc(Cc2nccc3cc(OC)c(OC)cc23)ccc1OCCOCCF
Show InChI InChI=1S/C23H26FNO5/c1-26-21-13-16(4-5-20(21)30-11-10-29-9-7-24)12-19-18-15-23(28-3)22(27-2)14-17(18)6-8-25-19/h4-6,8,13-15H,7,9-12H2,1-3H3
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n/an/a 28n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE10A assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Rattus norvegicus (rat))
BDBM14754
PNG
(1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-isoq...)
Show SMILES COc1ccc(Cc2nccc3cc(OC)c(OC)cc23)cc1OC
Show InChI InChI=1S/C20H21NO4/c1-22-17-6-5-13(10-18(17)23-2)9-16-15-12-20(25-4)19(24-3)11-14(15)7-8-21-16/h5-8,10-12H,9H2,1-4H3
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n/an/a 36n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of rat PDE10A


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))
BDBM50351892
PNG
(CHEMBL1821791)
Show SMILES COc1ccc(Cc2nccc3cc(OC)c(OC)cc23)cc1
Show InChI InChI=1S/C19H19NO3/c1-21-15-6-4-13(5-7-15)10-17-16-12-19(23-3)18(22-2)11-14(16)8-9-20-17/h4-9,11-12H,10H2,1-3H3
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n/an/a 48.8n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE10A assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))
BDBM50351908
PNG
(CHEMBL1821774)
Show SMILES COc1ccc(Cc2nccc3cc(OCCF)c(OC)cc23)cc1F
Show InChI InChI=1S/C20H19F2NO3/c1-24-18-4-3-13(9-16(18)22)10-17-15-12-19(25-2)20(26-8-6-21)11-14(15)5-7-23-17/h3-5,7,9,11-12H,6,8,10H2,1-2H3
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n/an/a 49n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE10A assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))
BDBM50351890
PNG
(CHEMBL1821787)
Show SMILES COc1ccc(Cc2nccc3cc(OC)c(OC)cc23)cc1OCCF
Show InChI InChI=1S/C21H22FNO4/c1-24-18-5-4-14(11-21(18)27-9-7-22)10-17-16-13-20(26-3)19(25-2)12-15(16)6-8-23-17/h4-6,8,11-13H,7,9-10H2,1-3H3
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n/an/a 55n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE10A assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))
BDBM50351894
PNG
(CHEMBL1821789)
Show SMILES COc1cc(Cc2nccc3cc(OC)c(OC)cc23)ccc1OCCF
Show InChI InChI=1S/C21H22FNO4/c1-24-19-11-14(4-5-18(19)27-9-7-22)10-17-16-13-21(26-3)20(25-2)12-15(16)6-8-23-17/h4-6,8,11-13H,7,9-10H2,1-3H3
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n/an/a 55n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE10A assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))
BDBM50351895
PNG
(CHEMBL1821775)
Show SMILES COc1ccc(Cc2nccc3cc(OCCF)c(OC)cc23)cc1C
Show InChI InChI=1S/C21H22FNO3/c1-14-10-15(4-5-19(14)24-2)11-18-17-13-20(25-3)21(26-9-7-22)12-16(17)6-8-23-18/h4-6,8,10,12-13H,7,9,11H2,1-3H3
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n/an/a 58.5n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE10A assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))
BDBM50351896
PNG
(CHEMBL1821776)
Show SMILES COc1cc2c(Cc3ccc(SC)cc3)nccc2cc1OCCF
Show InChI InChI=1S/C20H20FNO2S/c1-23-19-13-17-15(12-20(19)24-10-8-21)7-9-22-18(17)11-14-3-5-16(25-2)6-4-14/h3-7,9,12-13H,8,10-11H2,1-2H3
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n/an/a 112n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE10A assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))
BDBM50351897
PNG
(CHEMBL1821777)
Show SMILES COc1ccc(Cc2nccc3cc(OC)c(OCCF)cc23)cc1F
Show InChI InChI=1S/C20H19F2NO3/c1-24-18-4-3-13(9-16(18)22)10-17-15-12-20(26-8-6-21)19(25-2)11-14(15)5-7-23-17/h3-5,7,9,11-12H,6,8,10H2,1-2H3
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n/an/a 198n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE10A assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))
BDBM50351898
PNG
(CHEMBL1821784)
Show SMILES COc1ccc(Cc2nccc3cc(OC)c(OCCF)cc23)cc1OCCF
Show InChI InChI=1S/C22H23F2NO4/c1-26-19-4-3-15(12-21(19)28-9-6-23)11-18-17-14-22(29-10-7-24)20(27-2)13-16(17)5-8-25-18/h3-5,8,12-14H,6-7,9-11H2,1-2H3
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n/an/a 200n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE10A assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))
BDBM50351899
PNG
(CHEMBL1821779)
Show SMILES COc1cc2ccnc(Cc3ccc(SC)cc3)c2cc1OCCF
Show InChI InChI=1S/C20H20FNO2S/c1-23-19-12-15-7-9-22-18(17(15)13-20(19)24-10-8-21)11-14-3-5-16(25-2)6-4-14/h3-7,9,12-13H,8,10-11H2,1-2H3
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n/an/a 237n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE10A assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))
BDBM50351900
PNG
(CHEMBL1821778)
Show SMILES COc1ccc(Cc2nccc3cc(OC)c(OCCF)cc23)cc1C
Show InChI InChI=1S/C21H22FNO3/c1-14-10-15(4-5-19(14)24-2)11-18-17-13-21(26-9-7-22)20(25-3)12-16(17)6-8-23-18/h4-6,8,10,12-13H,7,9,11H2,1-3H3
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n/an/a 244n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE10A assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))
BDBM50351901
PNG
(CHEMBL1821788)
Show SMILES COc1cc(Cc2nccc3cc(OC)c(OCCF)cc23)ccc1OCCF
Show InChI InChI=1S/C22H23F2NO4/c1-26-20-12-15(3-4-19(20)28-9-6-23)11-18-17-14-22(29-10-7-24)21(27-2)13-16(17)5-8-25-18/h3-5,8,12-14H,6-7,9-11H2,1-2H3
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n/an/a 246n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE10A assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))
BDBM50351902
PNG
(CHEMBL1821782)
Show SMILES COc1ccc(Cc2nccc3cc(OC)c(OCCF)cc23)cc1Br
Show InChI InChI=1S/C20H19BrFNO3/c1-24-18-4-3-13(9-16(18)21)10-17-15-12-20(26-8-6-22)19(25-2)11-14(15)5-7-23-17/h3-5,7,9,11-12H,6,8,10H2,1-2H3
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n/an/a 248n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE10A assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))
BDBM50351903
PNG
(CHEMBL1821785)
Show SMILES COc1ccc(OC)c(Cc2nccc3cc(OC)c(OCCF)cc23)c1
Show InChI InChI=1S/C21H22FNO4/c1-24-16-4-5-19(25-2)15(10-16)11-18-17-13-21(27-9-7-22)20(26-3)12-14(17)6-8-23-18/h4-6,8,10,12-13H,7,9,11H2,1-3H3
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n/an/a 262n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE10A assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))
BDBM50351904
PNG
(CHEMBL1821786)
Show SMILES COc1cc(Cc2nccc3cc(OC)c(OCCF)cc23)ccc1F
Show InChI InChI=1S/C20H19F2NO3/c1-24-18-10-13(3-4-16(18)22)9-17-15-12-20(26-8-6-21)19(25-2)11-14(15)5-7-23-17/h3-5,7,10-12H,6,8-9H2,1-2H3
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n/an/a 303n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE10A assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))
BDBM50351905
PNG
(CHEMBL1821783)
Show SMILES COc1cc2ccnc(Cc3cccc(F)c3)c2cc1OCCF
Show InChI InChI=1S/C19H17F2NO2/c1-23-18-11-14-5-7-22-17(10-13-3-2-4-15(21)9-13)16(14)12-19(18)24-8-6-20/h2-5,7,9,11-12H,6,8,10H2,1H3
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n/an/a 469n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE10A assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))
BDBM50351906
PNG
(CHEMBL1821780)
Show SMILES COc1ccc(Cc2nccc3cc(OC)c(OCCF)cc23)c(F)c1
Show InChI InChI=1S/C20H19F2NO3/c1-24-15-4-3-14(17(22)11-15)9-18-16-12-20(26-8-6-21)19(25-2)10-13(16)5-7-23-18/h3-5,7,10-12H,6,8-9H2,1-2H3
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n/an/a 500n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE10A assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))
BDBM50351907
PNG
(CHEMBL1821781)
Show SMILES COc1ccc(Br)cc1Cc1nccc2cc(OC)c(OCCF)cc12
Show InChI InChI=1S/C20H19BrFNO3/c1-24-18-4-3-15(21)9-14(18)10-17-16-12-20(26-8-6-22)19(25-2)11-13(16)5-7-23-17/h3-5,7,9,11-12H,6,8,10H2,1-2H3
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n/an/a 872n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PDE10A assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cGMP-inhibited 3',5'-cyclic phosphodiesterase 3A


(Homo sapiens (Human))
BDBM14754
PNG
(1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-isoq...)
Show SMILES COc1ccc(Cc2nccc3cc(OC)c(OC)cc23)cc1OC
Show InChI InChI=1S/C20H21NO4/c1-22-17-6-5-13(10-18(17)23-2)9-16-15-12-20(25-4)19(24-3)11-14(15)7-8-21-16/h5-8,10-12H,9H2,1-4H3
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n/an/a 917n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of PDE3A assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cGMP-inhibited 3',5'-cyclic phosphodiesterase 3B


(Homo sapiens (Human))
BDBM14754
PNG
(1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-isoq...)
Show SMILES COc1ccc(Cc2nccc3cc(OC)c(OC)cc23)cc1OC
Show InChI InChI=1S/C20H21NO4/c1-22-17-6-5-13(10-18(17)23-2)9-16-15-12-20(25-4)19(24-3)11-14(15)7-8-21-16/h5-8,10-12H,9H2,1-4H3
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n/an/a 1.03E+3n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of PDE3B assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cGMP-inhibited 3',5'-cyclic phosphodiesterase 3A


(Homo sapiens (Human))
BDBM50351895
PNG
(CHEMBL1821775)
Show SMILES COc1ccc(Cc2nccc3cc(OCCF)c(OC)cc23)cc1C
Show InChI InChI=1S/C21H22FNO3/c1-14-10-15(4-5-19(14)24-2)11-18-17-13-20(25-3)21(26-9-7-22)12-16(17)6-8-23-18/h4-6,8,10,12-13H,7,9,11H2,1-3H3
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n/an/a 1.19E+3n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of PDE3A assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cGMP-inhibited 3',5'-cyclic phosphodiesterase 3B


(Homo sapiens (Human))
BDBM50351908
PNG
(CHEMBL1821774)
Show SMILES COc1ccc(Cc2nccc3cc(OCCF)c(OC)cc23)cc1F
Show InChI InChI=1S/C20H19F2NO3/c1-24-18-4-3-13(9-16(18)22)10-17-15-12-19(25-2)20(26-8-6-21)11-14(15)5-7-23-17/h3-5,7,9,11-12H,6,8,10H2,1-2H3
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n/an/a 1.25E+3n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of PDE3B assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cGMP-inhibited 3',5'-cyclic phosphodiesterase 3A


(Homo sapiens (Human))
BDBM50351908
PNG
(CHEMBL1821774)
Show SMILES COc1ccc(Cc2nccc3cc(OCCF)c(OC)cc23)cc1F
Show InChI InChI=1S/C20H19F2NO3/c1-24-18-4-3-13(9-16(18)22)10-17-15-12-19(25-2)20(26-8-6-21)11-14(15)5-7-23-17/h3-5,7,9,11-12H,6,8,10H2,1-2H3
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n/an/a 1.29E+3n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of PDE3A assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cGMP-inhibited 3',5'-cyclic phosphodiesterase 3B


(Homo sapiens (Human))
BDBM50351895
PNG
(CHEMBL1821775)
Show SMILES COc1ccc(Cc2nccc3cc(OCCF)c(OC)cc23)cc1C
Show InChI InChI=1S/C21H22FNO3/c1-14-10-15(4-5-19(14)24-2)11-18-17-13-20(25-3)21(26-9-7-22)12-16(17)6-8-23-18/h4-6,8,10,12-13H,7,9,11H2,1-3H3
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n/an/a 1.67E+3n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of PDE3B assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cGMP-inhibited 3',5'-cyclic phosphodiesterase 3A


(Homo sapiens (Human))
BDBM50351894
PNG
(CHEMBL1821789)
Show SMILES COc1cc(Cc2nccc3cc(OC)c(OC)cc23)ccc1OCCF
Show InChI InChI=1S/C21H22FNO4/c1-24-19-11-14(4-5-18(19)27-9-7-22)10-17-16-13-21(26-3)20(25-2)12-15(16)6-8-23-17/h4-6,8,11-13H,7,9-10H2,1-3H3
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n/an/a 1.74E+3n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of PDE3A assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cGMP-inhibited 3',5'-cyclic phosphodiesterase 3A


(Homo sapiens (Human))
BDBM50351890
PNG
(CHEMBL1821787)
Show SMILES COc1ccc(Cc2nccc3cc(OC)c(OC)cc23)cc1OCCF
Show InChI InChI=1S/C21H22FNO4/c1-24-18-5-4-14(11-21(18)27-9-7-22)10-17-16-13-20(26-3)19(25-2)12-15(16)6-8-23-17/h4-6,8,11-13H,7,9-10H2,1-3H3
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n/an/a 1.94E+3n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of PDE3A assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cGMP-inhibited 3',5'-cyclic phosphodiesterase 3B


(Homo sapiens (Human))
BDBM50351894
PNG
(CHEMBL1821789)
Show SMILES COc1cc(Cc2nccc3cc(OC)c(OC)cc23)ccc1OCCF
Show InChI InChI=1S/C21H22FNO4/c1-24-19-11-14(4-5-18(19)27-9-7-22)10-17-16-13-21(26-3)20(25-2)12-15(16)6-8-23-17/h4-6,8,11-13H,7,9-10H2,1-3H3
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n/an/a 2.17E+3n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of PDE3B assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cGMP-inhibited 3',5'-cyclic phosphodiesterase 3A


(Homo sapiens (Human))
BDBM50351891
PNG
(CHEMBL1821790)
Show SMILES COc1cc(Cc2nccc3cc(OC)c(OC)cc23)ccc1OCCOCCF
Show InChI InChI=1S/C23H26FNO5/c1-26-21-13-16(4-5-20(21)30-11-10-29-9-7-24)12-19-18-15-23(28-3)22(27-2)14-17(18)6-8-25-19/h4-6,8,13-15H,7,9-12H2,1-3H3
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n/an/a 2.20E+3n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of PDE3A assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cGMP-inhibited 3',5'-cyclic phosphodiesterase 3B


(Homo sapiens (Human))
BDBM50351890
PNG
(CHEMBL1821787)
Show SMILES COc1ccc(Cc2nccc3cc(OC)c(OC)cc23)cc1OCCF
Show InChI InChI=1S/C21H22FNO4/c1-24-18-5-4-14(11-21(18)27-9-7-22)10-17-16-13-20(26-3)19(25-2)12-15(16)6-8-23-17/h4-6,8,11-13H,7,9-10H2,1-3H3
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n/an/a 2.51E+3n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of PDE3B assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cGMP-inhibited 3',5'-cyclic phosphodiesterase 3B


(Homo sapiens (Human))
BDBM50351891
PNG
(CHEMBL1821790)
Show SMILES COc1cc(Cc2nccc3cc(OC)c(OC)cc23)ccc1OCCOCCF
Show InChI InChI=1S/C23H26FNO5/c1-26-21-13-16(4-5-20(21)30-11-10-29-9-7-24)12-19-18-15-23(28-3)22(27-2)14-17(18)6-8-25-19/h4-6,8,13-15H,7,9-12H2,1-3H3
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n/an/a 2.52E+3n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of PDE3B assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cGMP-inhibited 3',5'-cyclic phosphodiesterase 3B


(Homo sapiens (Human))
BDBM50351892
PNG
(CHEMBL1821791)
Show SMILES COc1ccc(Cc2nccc3cc(OC)c(OC)cc23)cc1
Show InChI InChI=1S/C19H19NO3/c1-21-15-6-4-13(5-7-15)10-17-16-12-19(23-3)18(22-2)11-14(16)8-9-20-17/h4-9,11-12H,10H2,1-3H3
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n/an/a 3.10E+3n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of PDE3B assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
cGMP-inhibited 3',5'-cyclic phosphodiesterase 3A


(Homo sapiens (Human))
BDBM50351892
PNG
(CHEMBL1821791)
Show SMILES COc1ccc(Cc2nccc3cc(OC)c(OC)cc23)cc1
Show InChI InChI=1S/C19H19NO3/c1-21-15-6-4-13(5-7-15)10-17-16-12-19(23-3)18(22-2)11-14(16)8-9-20-17/h4-9,11-12H,10H2,1-3H3
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n/an/a 3.98E+3n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibition of PDE3A assessed as reduction in hydrolysis of [3H]cAMP by scintillation proximity assay


Eur J Med Chem 46: 3986-95 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.072
BindingDB Entry DOI: 10.7270/Q279452C
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%