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9 similar compounds to monomer 50350804

Compile data set for download or QSAR
Wt: 426.5
BDBM50350792
Wt: 476.5
BDBM50350793
Wt: 439.5
BDBM50350794
Wt: 440.5
BDBM50350795
Wt: 440.5
BDBM50350796
Wt: 349.4
BDBM50350802
Wt: 490.5
BDBM50350803
Wt: 377.4
BDBM50350805
Wt: 426.5
BDBM50350806

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 11 hits for monomerid = 50350792,50350793,50350794,50350795,50350796,50350802,50350803,50350805,50350806   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Phosphodiesterase Type 10 (PDE10A)


(Rattus norvegicus (rat))
BDBM50350792
PNG
(CHEMBL1819125)
Show SMILES COc1cc2ncnc(N3CCCC(C3)c3ccccc3)c2cc1OCc1ccncc1
Show InChI InChI=1S/C26H26N4O2/c1-31-24-15-23-22(14-25(24)32-17-19-9-11-27-12-10-19)26(29-18-28-23)30-13-5-8-21(16-30)20-6-3-2-4-7-20/h2-4,6-7,9-12,14-15,18,21H,5,8,13,16-17H2,1H3
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n/an/a>3.20E+3n/an/an/an/an/an/a



Pfizer Inc

Curated by ChEMBL


Assay Description
Inhibition of recombinant rat PDE10A expressed in Sf9 cells using [3H]cAMP after 30 mins by scintillation proximity assay


J Med Chem 54: 4536-47 (2011)


Article DOI: 10.1021/jm2001508
BindingDB Entry DOI: 10.7270/Q2PN961Q
More data for this
Ligand-Target Pair
Phosphodiesterase Type 10 (PDE10A)


(Rattus norvegicus (rat))
BDBM50350793
PNG
(CHEMBL1819126)
Show SMILES COc1cc2ncnc(N3CCCC(C3)c3ccccc3)c2cc1OCc1ccc2ccccc2n1
Show InChI InChI=1S/C30H28N4O2/c1-35-28-17-27-25(16-29(28)36-19-24-14-13-22-10-5-6-12-26(22)33-24)30(32-20-31-27)34-15-7-11-23(18-34)21-8-3-2-4-9-21/h2-6,8-10,12-14,16-17,20,23H,7,11,15,18-19H2,1H3
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n/an/a>3.20E+3n/an/an/an/an/an/a



Pfizer Inc

Curated by ChEMBL


Assay Description
Inhibition of recombinant rat PDE10A expressed in Sf9 cells using [3H]cAMP after 30 mins by scintillation proximity assay


J Med Chem 54: 4536-47 (2011)


Article DOI: 10.1021/jm2001508
BindingDB Entry DOI: 10.7270/Q2PN961Q
More data for this
Ligand-Target Pair
Phosphodiesterase Type 10 (PDE10A)


(Rattus norvegicus (rat))
BDBM50350794
PNG
(CHEMBL1819127)
Show SMILES COc1cc2ncnc(N3CCCC(C3)c3ccccc3)c2cc1OCCc1ccccc1
Show InChI InChI=1S/C28H29N3O2/c1-32-26-18-25-24(17-27(26)33-16-14-21-9-4-2-5-10-21)28(30-20-29-25)31-15-8-13-23(19-31)22-11-6-3-7-12-22/h2-7,9-12,17-18,20,23H,8,13-16,19H2,1H3
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n/an/a 1.67E+3n/an/an/an/an/an/a



Pfizer Inc

Curated by ChEMBL


Assay Description
Inhibition of recombinant rat PDE10A expressed in Sf9 cells using [3H]cAMP after 30 mins by scintillation proximity assay


J Med Chem 54: 4536-47 (2011)


Article DOI: 10.1021/jm2001508
BindingDB Entry DOI: 10.7270/Q2PN961Q
More data for this
Ligand-Target Pair
Phosphodiesterase Type 10 (PDE10A)


(Rattus norvegicus (rat))
BDBM50350795
PNG
(CHEMBL1819129)
Show SMILES COc1cc2ncnc(N3CCCC(C3)c3ccccc3)c2cc1OCCc1cccnc1
Show InChI InChI=1S/C27H28N4O2/c1-32-25-16-24-23(15-26(25)33-14-11-20-7-5-12-28-17-20)27(30-19-29-24)31-13-6-10-22(18-31)21-8-3-2-4-9-21/h2-5,7-9,12,15-17,19,22H,6,10-11,13-14,18H2,1H3
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n/an/a 2.34E+3n/an/an/an/an/an/a



Pfizer Inc

Curated by ChEMBL


Assay Description
Inhibition of recombinant rat PDE10A expressed in Sf9 cells using [3H]cAMP after 30 mins by scintillation proximity assay


J Med Chem 54: 4536-47 (2011)


Article DOI: 10.1021/jm2001508
BindingDB Entry DOI: 10.7270/Q2PN961Q
More data for this
Ligand-Target Pair
Phosphodiesterase Type 10 (PDE10A)


(Rattus norvegicus (rat))
BDBM50350796
PNG
(CHEMBL1819130)
Show SMILES COc1cc2ncnc(N3CCCC(C3)c3ccccc3)c2cc1OCCc1ccncc1
Show InChI InChI=1S/C27H28N4O2/c1-32-25-17-24-23(16-26(25)33-15-11-20-9-12-28-13-10-20)27(30-19-29-24)31-14-5-8-22(18-31)21-6-3-2-4-7-21/h2-4,6-7,9-10,12-13,16-17,19,22H,5,8,11,14-15,18H2,1H3
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n/an/a>3.20E+3n/an/an/an/an/an/a



Pfizer Inc

Curated by ChEMBL


Assay Description
Inhibition of recombinant rat PDE10A expressed in Sf9 cells using [3H]cAMP after 30 mins by scintillation proximity assay


J Med Chem 54: 4536-47 (2011)


Article DOI: 10.1021/jm2001508
BindingDB Entry DOI: 10.7270/Q2PN961Q
More data for this
Ligand-Target Pair
Phosphodiesterase Type 10 (PDE10A)


(Rattus norvegicus (rat))
BDBM50350806
PNG
(CHEMBL1819123)
Show SMILES COc1cc2ncnc(N3CCCC(C3)c3ccccc3)c2cc1OCc1ccccn1
Show InChI InChI=1S/C26H26N4O2/c1-31-24-15-23-22(14-25(24)32-17-21-11-5-6-12-27-21)26(29-18-28-23)30-13-7-10-20(16-30)19-8-3-2-4-9-19/h2-6,8-9,11-12,14-15,18,20H,7,10,13,16-17H2,1H3
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n/an/a>3.20E+3n/an/an/an/an/an/a



Pfizer Inc

Curated by ChEMBL


Assay Description
Inhibition of recombinant rat PDE10A expressed in Sf9 cells using [3H]cAMP after 30 mins by scintillation proximity assay


J Med Chem 54: 4536-47 (2011)


Article DOI: 10.1021/jm2001508
BindingDB Entry DOI: 10.7270/Q2PN961Q
More data for this
Ligand-Target Pair
Phosphodiesterase Type 10 (PDE10A)


(Rattus norvegicus (rat))
BDBM50350803
PNG
(CHEMBL1819131)
Show SMILES COc1cc2ncnc(N3CCCC(C3)c3ccccc3)c2cc1OCCc1ccc2ccccc2n1
Show InChI InChI=1S/C31H30N4O2/c1-36-29-19-28-26(18-30(29)37-17-15-25-14-13-23-10-5-6-12-27(23)34-25)31(33-21-32-28)35-16-7-11-24(20-35)22-8-3-2-4-9-22/h2-6,8-10,12-14,18-19,21,24H,7,11,15-17,20H2,1H3
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n/an/a 12n/an/an/an/an/an/a



Pfizer Inc

Curated by ChEMBL


Assay Description
Inhibition of recombinant rat PDE10A expressed in Sf9 cells using [3H]cAMP after 30 mins by scintillation proximity assay


J Med Chem 54: 4536-47 (2011)


Article DOI: 10.1021/jm2001508
BindingDB Entry DOI: 10.7270/Q2PN961Q
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Phosphodiesterase 3 (PDE3)


(Homo sapiens (Human))
BDBM50350802
PNG
(CHEMBL1819121)
Show SMILES COc1cc2ncnc(N3CCCC(C3)c3ccccc3)c2cc1OC
Show InChI InChI=1S/C21H23N3O2/c1-25-19-11-17-18(12-20(19)26-2)22-14-23-21(17)24-10-6-9-16(13-24)15-7-4-3-5-8-15/h3-5,7-8,11-12,14,16H,6,9-10,13H2,1-2H3
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n/an/a 8.5n/an/an/an/an/an/a



Pfizer Inc

Curated by ChEMBL


Assay Description
Inhibition of PDE3A


J Med Chem 54: 4536-47 (2011)


Article DOI: 10.1021/jm2001508
BindingDB Entry DOI: 10.7270/Q2PN961Q
More data for this
Ligand-Target Pair
Phosphodiesterase 3 (PDE3)


(Homo sapiens (Human))
BDBM50350805
PNG
(CHEMBL1819122)
Show SMILES CCCOc1cc2c(ncnc2cc1OC)N1CCCC(C1)c1ccccc1
Show InChI InChI=1S/C23H27N3O2/c1-3-12-28-22-13-19-20(14-21(22)27-2)24-16-25-23(19)26-11-7-10-18(15-26)17-8-5-4-6-9-17/h4-6,8-9,13-14,16,18H,3,7,10-12,15H2,1-2H3
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n/an/a 98n/an/an/an/an/an/a



Pfizer Inc

Curated by ChEMBL


Assay Description
Inhibition of PDE3A


J Med Chem 54: 4536-47 (2011)


Article DOI: 10.1021/jm2001508
BindingDB Entry DOI: 10.7270/Q2PN961Q
More data for this
Ligand-Target Pair
Phosphodiesterase Type 10 (PDE10A)


(Rattus norvegicus (rat))
BDBM50350805
PNG
(CHEMBL1819122)
Show SMILES CCCOc1cc2c(ncnc2cc1OC)N1CCCC(C1)c1ccccc1
Show InChI InChI=1S/C23H27N3O2/c1-3-12-28-22-13-19-20(14-21(22)27-2)24-16-25-23(19)26-11-7-10-18(15-26)17-8-5-4-6-9-17/h4-6,8-9,13-14,16,18H,3,7,10-12,15H2,1-2H3
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n/an/a 1.04E+3n/an/an/an/an/an/a



Pfizer Inc

Curated by ChEMBL


Assay Description
Inhibition of recombinant rat PDE10A expressed in Sf9 cells using [3H]cAMP after 30 mins by scintillation proximity assay


J Med Chem 54: 4536-47 (2011)


Article DOI: 10.1021/jm2001508
BindingDB Entry DOI: 10.7270/Q2PN961Q
More data for this
Ligand-Target Pair
Phosphodiesterase Type 10 (PDE10A)


(Rattus norvegicus (rat))
BDBM50350802
PNG
(CHEMBL1819121)
Show SMILES COc1cc2ncnc(N3CCCC(C3)c3ccccc3)c2cc1OC
Show InChI InChI=1S/C21H23N3O2/c1-25-19-11-17-18(12-20(19)26-2)22-14-23-21(17)24-10-6-9-16(13-24)15-7-4-3-5-8-15/h3-5,7-8,11-12,14,16H,6,9-10,13H2,1-2H3
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n/an/a 146n/an/an/an/an/an/a



Pfizer Inc

Curated by ChEMBL


Assay Description
Inhibition of recombinant rat PDE10A expressed in Sf9 cells using [3H]cAMP after 30 mins by scintillation proximity assay


J Med Chem 54: 4536-47 (2011)


Article DOI: 10.1021/jm2001508
BindingDB Entry DOI: 10.7270/Q2PN961Q
More data for this
Ligand-Target Pair