BindingDB logo
myBDB logout

USPatent US8772510

Compile data set for download or QSAR
Found 65 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


(Homo sapiens (Human))		BDBM125036
PNG
(US8772510, 55)
Show SMILES Cn1ncc(C(=O)N2CCC2)c1C(=O)NCCc1nc(nn1-c1ccccc1)-c1ccccc1
Show InChI InChI=1S/C25H25N7O2/c1-30-22(20(17-27-30)25(34)31-15-8-16-31)24(33)26-14-13-21-28-23(18-9-4-2-5-10-18)29-32(21)19-11-6-3-7-12-19/h2-7,9-12,17H,8,13-16H2,1H3,(H,26,33)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 0.390n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125038
PNG
(US8772510, 57)
Show SMILES Cn1ncc(C(=O)N2CCC2)c1C(=O)NCCc1nc(nn1-c1ccccn1)-c1ccccc1
Show InChI InChI=1S/C24H24N8O2/c1-30-21(18(16-27-30)24(34)31-14-7-15-31)23(33)26-13-11-20-28-22(17-8-3-2-4-9-17)29-32(20)19-10-5-6-12-25-19/h2-6,8-10,12,16H,7,11,13-15H2,1H3,(H,26,33)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
PDB
UniChem

Similars
PDB
US Patent
n/an/a 0.470n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125040
PNG
(Roche-Dataset for PDE10A, Compound 21 | US8772510,...)
Show SMILES Cn1ncc(C(=O)N2CCC2)c1C(=O)NCCc1nc(nn1-c1cccnc1)-c1ccccc1
Show InChI InChI=1S/C24H24N8O2/c1-30-21(19(16-27-30)24(34)31-13-6-14-31)23(33)26-12-10-20-28-22(17-7-3-2-4-8-17)29-32(20)18-9-5-11-25-15-18/h2-5,7-9,11,15-16H,6,10,12-14H2,1H3,(H,26,33)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 0.530n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125041
PNG
(Roche-Dataset for PDE10A, Compound 0 | US8772510, ...)
Show SMILES Cn1ncc(C(=O)N2CCC2)c1C(=O)NCCc1nc(nn1-c1ccccc1)-c1cccc(F)c1
Show InChI InChI=1S/C25H24FN7O2/c1-31-22(20(16-28-31)25(35)32-13-6-14-32)24(34)27-12-11-21-29-23(17-7-5-8-18(26)15-17)30-33(21)19-9-3-2-4-10-19/h2-5,7-10,15-16H,6,11-14H2,1H3,(H,27,34)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 0.670n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125039
PNG
(US8772510, 58)
Show SMILES Cn1ncc(C(=O)N2CCC2)c1C(=O)NCCc1nc(oc1-c1ccccc1)-c1ccccc1
Show InChI InChI=1S/C26H25N5O3/c1-30-22(20(17-28-30)26(33)31-15-8-16-31)24(32)27-14-13-21-23(18-9-4-2-5-10-18)34-25(29-21)19-11-6-3-7-12-19/h2-7,9-12,17H,8,13-16H2,1H3,(H,27,32)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 0.700n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125012
PNG
(Roche-Dataset for PDE10A, Compound 130 | US8772510...)
Show SMILES COc1ccccc1-c1cn(C)c(CCNC(=O)c2c(cnn2C)C(=O)N2CCC2)n1
Show InChI InChI=1S/C22H26N6O3/c1-26-14-17(15-7-4-5-8-18(15)31-3)25-19(26)9-10-23-21(29)20-16(13-24-27(20)2)22(30)28-11-6-12-28/h4-5,7-8,13-14H,6,9-12H2,1-3H3,(H,23,29)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 1.70n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125046
PNG
(Roche-Dataset for PDE10A, Compound 22 | US8772510,...)
Show SMILES Cn1ncc(C(=O)N2CCC2)c1C(=O)NCCc1nc(oc1-c1cccnc1)-c1ccccc1
Show InChI InChI=1S/C25H24N6O3/c1-30-21(19(16-28-30)25(33)31-13-6-14-31)23(32)27-12-10-20-22(18-9-5-11-26-15-18)34-24(29-20)17-7-3-2-4-8-17/h2-5,7-9,11,15-16H,6,10,12-14H2,1H3,(H,27,32)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 1.83n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125013
PNG
(Roche-Dataset for PDE10A, Compound 10 | US8772510,...)
Show SMILES COCCn1cc(nc1CCNC(=O)c1c(cnn1C)C(=O)N1CCC1)-c1ccccc1
Show InChI InChI=1S/C23H28N6O3/c1-27-21(18(15-25-27)23(31)28-11-6-12-28)22(30)24-10-9-20-26-19(16-29(20)13-14-32-2)17-7-4-3-5-8-17/h3-5,7-8,15-16H,6,9-14H2,1-2H3,(H,24,30)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 3.10n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125037
PNG
(Roche-Dataset for PDE10A, Compound 78 | US8772510,...)
Show SMILES Cn1ncc(C(=O)N2CCC2)c1C(=O)NCCc1nc(nn1C1CC1)-c1ccccc1
Show InChI InChI=1S/C22H25N7O2/c1-27-19(17(14-24-27)22(31)28-12-5-13-28)21(30)23-11-10-18-25-20(15-6-3-2-4-7-15)26-29(18)16-8-9-16/h2-4,6-7,14,16H,5,8-13H2,1H3,(H,23,30)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 3.41n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125026
PNG
(Roche-Dataset for PDE10A, Compound 30 | US8772510,...)
Show SMILES Cn1ncc(C(=O)N2CCC2)c1C(=O)NCCc1nc(nn1Cc1ccccc1)-c1ccccc1
Show InChI InChI=1S/C26H27N7O2/c1-31-23(21(17-28-31)26(35)32-15-8-16-32)25(34)27-14-13-22-29-24(20-11-6-3-7-12-20)30-33(22)18-19-9-4-2-5-10-19/h2-7,9-12,17H,8,13-16,18H2,1H3,(H,27,34)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 3.70n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125017
PNG
(Roche-Dataset for PDE10A, Compound 267 | US8772510...)
Show SMILES Cn1ncc(C(=O)N2CCC2)c1C(=O)NCCc1nc(n[nH]1)-c1ccccc1
Show InChI InChI=1S/C19H21N7O2/c1-25-16(14(12-21-25)19(28)26-10-5-11-26)18(27)20-9-8-15-22-17(24-23-15)13-6-3-2-4-7-13/h2-4,6-7,12H,5,8-11H2,1H3,(H,20,27)(H,22,23,24)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 3.77n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM124988
PNG
(US8772510, 7)
Show SMILES Cn1cc(nc1CCNC(=O)c1c(cnn1C)C(=O)N1CCC1)-c1ccccc1
Show InChI InChI=1S/C21H24N6O2/c1-25-14-17(15-7-4-3-5-8-15)24-18(25)9-10-22-20(28)19-16(13-23-26(19)2)21(29)27-11-6-12-27/h3-5,7-8,13-14H,6,9-12H2,1-2H3,(H,22,28)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 4n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125016
PNG
(Roche-Dataset for PDE10A, Compound 32 | US8772510,...)
Show SMILES Cn1ncc(C(=O)N2CCC2)c1C(=O)NCCc1nc(nn1CC1CC1)-c1ccccc1
Show InChI InChI=1S/C23H27N7O2/c1-28-20(18(14-25-28)23(32)29-12-5-13-29)22(31)24-11-10-19-26-21(17-6-3-2-4-7-17)27-30(19)15-16-8-9-16/h2-4,6-7,14,16H,5,8-13,15H2,1H3,(H,24,31)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 5.66n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125043
PNG
(Roche-Dataset for PDE10A, Compound 80 | US8772510,...)
Show SMILES CN(C1CCC1)C(=O)c1cnn(C)c1C(=O)NCCc1nc(cn1C)-c1ccccc1
Show InChI InChI=1S/C23H28N6O2/c1-27-15-19(16-8-5-4-6-9-16)26-20(27)12-13-24-22(30)21-18(14-25-29(21)3)23(31)28(2)17-10-7-11-17/h4-6,8-9,14-15,17H,7,10-13H2,1-3H3,(H,24,30)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 7.41n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125008
PNG
(Roche-Dataset for PDE10A, Compound 151 | US8772510...)
Show SMILES Cn1cc(nc1CCNC(=O)c1c(cnn1C)C(=O)N1CCC1)-c1cccnc1
Show InChI InChI=1S/C20H23N7O2/c1-25-13-16(14-5-3-7-21-11-14)24-17(25)6-8-22-19(28)18-15(12-23-26(18)2)20(29)27-9-4-10-27/h3,5,7,11-13H,4,6,8-10H2,1-2H3,(H,22,28)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 11n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125005
PNG
(US8772510, 24)
Show SMILES Cn1cc(nc1CCNC(=O)c1c(cnn1C)C(=O)N1CCOCC1)-c1ccccc1
Show InChI InChI=1S/C22H26N6O3/c1-26-15-18(16-6-4-3-5-7-16)25-19(26)8-9-23-21(29)20-17(14-24-27(20)2)22(30)28-10-12-31-13-11-28/h3-7,14-15H,8-13H2,1-2H3,(H,23,29)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 12.4n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM124985
PNG
(US8772510, 4)
Show SMILES Cn1ncc(C(=O)N2CCC2)c1C(=O)NCCc1nc(n[nH]1)-c1cccnc1
Show InChI InChI=1S/C18H20N8O2/c1-25-15(13(11-21-25)18(28)26-8-3-9-26)17(27)20-7-5-14-22-16(24-23-14)12-4-2-6-19-10-12/h2,4,6,10-11H,3,5,7-9H2,1H3,(H,20,27)(H,22,23,24)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 13.4n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125021
PNG
(US8772510, 40)
Show SMILES CN(C1CC1)C(=O)c1cnn(C)c1C(=O)NCCc1nc(oc1C)-c1ccccc1
Show InChI InChI=1S/C22H25N5O3/c1-14-18(25-21(30-14)15-7-5-4-6-8-15)11-12-23-20(28)19-17(13-24-27(19)3)22(29)26(2)16-9-10-16/h4-8,13,16H,9-12H2,1-3H3,(H,23,28)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 13.8n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125001
PNG
(US8772510, 20)
Show SMILES Cc1oc(nc1CCNC(=O)c1c(cnn1C)C(=O)N1CCC1)-c1ccccc1
Show InChI InChI=1S/C21H23N5O3/c1-14-17(24-20(29-14)15-7-4-3-5-8-15)9-10-22-19(27)18-16(13-23-25(18)2)21(28)26-11-6-12-26/h3-5,7-8,13H,6,9-12H2,1-2H3,(H,22,27)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 14.5n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125028
PNG
(US8772510, 47)
Show SMILES Cc1cn(nc1CCNC(=O)c1c(cnn1C)C(=O)N1CCC1)-c1ccccc1
Show InChI InChI=1S/C21H24N6O2/c1-15-14-27(16-7-4-3-5-8-16)24-18(15)9-10-22-20(28)19-17(13-23-25(19)2)21(29)26-11-6-12-26/h3-5,7-8,13-14H,6,9-12H2,1-2H3,(H,22,28)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 14.5n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM124983
PNG
(US8772510, 2)
Show SMILES Cn1ncc(C(=O)N2CCC2)c1C(=O)NCCc1nc2ccccc2n1C
Show InChI InChI=1S/C19H22N6O2/c1-23-15-7-4-3-6-14(15)22-16(23)8-9-20-18(26)17-13(12-21-24(17)2)19(27)25-10-5-11-25/h3-4,6-7,12H,5,8-11H2,1-2H3,(H,20,26)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
PDB
UniChem

Similars
PDB
US Patent
n/an/a 16n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125024
PNG
(US8772510, 43)
Show SMILES Cc1sc(nc1CCNC(=O)c1c(cnn1C)C(=O)N1CCC1)-c1ccccc1
Show InChI InChI=1S/C21H23N5O2S/c1-14-17(24-20(29-14)15-7-4-3-5-8-15)9-10-22-19(27)18-16(13-23-25(18)2)21(28)26-11-6-12-26/h3-5,7-8,13H,6,9-12H2,1-2H3,(H,22,27)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 16.8n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125020
PNG
(US8772510, 39)
Show SMILES Cc1oc(nc1CCNC(=O)c1c(cnn1C)C(=O)N1CC(F)C1)-c1ccccc1
Show InChI InChI=1S/C21H22FN5O3/c1-13-17(25-20(30-13)14-6-4-3-5-7-14)8-9-23-19(28)18-16(10-24-26(18)2)21(29)27-11-15(22)12-27/h3-7,10,15H,8-9,11-12H2,1-2H3,(H,23,28)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 18.5n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125009
PNG
(US8772510, 28)
Show SMILES Cn1ncc(C(=O)N2CCC2)c1C(=O)NCCc1ccn(n1)-c1ccccc1
Show InChI InChI=1S/C20H22N6O2/c1-24-18(17(14-22-24)20(28)25-11-5-12-25)19(27)21-10-8-15-9-13-26(23-15)16-6-3-2-4-7-16/h2-4,6-7,9,13-14H,5,8,10-12H2,1H3,(H,21,27)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 19.3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM124997
PNG
(US8772510, 16)
Show SMILES Cn1ncc(C(=O)N2CCC2)c1C(=O)NCCc1nc2cc(Cl)ccc2n1C
Show InChI InChI=1S/C19H21ClN6O2/c1-24-15-5-4-12(20)10-14(15)23-16(24)6-7-21-18(27)17-13(11-22-25(17)2)19(28)26-8-3-9-26/h4-5,10-11H,3,6-9H2,1-2H3,(H,21,27)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 20.5n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125003
PNG
(US8772510, 22)
Show SMILES Cn1nc(nc1CCNC(=O)c1c(cnn1C)C(=O)N1CCC1)-c1ccccc1
Show InChI InChI=1S/C20H23N7O2/c1-25-16(23-18(24-25)14-7-4-3-5-8-14)9-10-21-19(28)17-15(13-22-26(17)2)20(29)27-11-6-12-27/h3-5,7-8,13H,6,9-12H2,1-2H3,(H,21,28)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 21.3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125007
PNG
(US8772510, 26)
Show SMILES Cn1ncc(C(=O)N2CCC2)c1C(=O)NCCc1csc(n1)-c1ncccn1
Show InChI InChI=1S/C18H19N7O2S/c1-24-14(13(10-22-24)18(27)25-8-3-9-25)16(26)21-7-4-12-11-28-17(23-12)15-19-5-2-6-20-15/h2,5-6,10-11H,3-4,7-9H2,1H3,(H,21,26)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 23.8n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125019
PNG
(US8772510, 38)
Show SMILES Cc1oc(nc1CCNC(=O)c1c(cnn1C)C(=O)N1CCCC1)-c1ccccc1
Show InChI InChI=1S/C22H25N5O3/c1-15-18(25-21(30-15)16-8-4-3-5-9-16)10-11-23-20(28)19-17(14-24-26(19)2)22(29)27-12-6-7-13-27/h3-5,8-9,14H,6-7,10-13H2,1-2H3,(H,23,28)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 27.3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125034
PNG
(US8772510, 53)
Show SMILES CN(C1CC1)C(=O)c1cnn(C)c1C(=O)NCCc1nc2ccccc2n1C
Show InChI InChI=1S/C20H24N6O2/c1-24(13-8-9-13)20(28)14-12-22-26(3)18(14)19(27)21-11-10-17-23-15-6-4-5-7-16(15)25(17)2/h4-7,12-13H,8-11H2,1-3H3,(H,21,27)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 31n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125010
PNG
(US8772510, 29)
Show SMILES Cn1ncc(C(=O)N2CCC2)c1C(=O)NCCc1csc(n1)-c1ccccc1
Show InChI InChI=1S/C20H21N5O2S/c1-24-17(16(12-22-24)20(27)25-10-5-11-25)18(26)21-9-8-15-13-28-19(23-15)14-6-3-2-4-7-14/h2-4,6-7,12-13H,5,8-11H2,1H3,(H,21,26)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 32.8n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM124992
PNG
(US8772510, 11)
Show SMILES Cc1ccc2n(C)c(CCNC(=O)c3c(cnn3C)C(=O)N3CCC3)nc2c1
Show InChI InChI=1S/C20H24N6O2/c1-13-5-6-16-15(11-13)23-17(24(16)2)7-8-21-19(27)18-14(12-22-25(18)3)20(28)26-9-4-10-26/h5-6,11-12H,4,7-10H2,1-3H3,(H,21,27)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 34.5n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125011
PNG
(Roche-Dataset for PDE10A, Compound 67 | US8772510,...)
Show SMILES COc1cccc(c1)-c1cn(C)c(CCNC(=O)c2c(cnn2C)C(=O)N2CCC2)n1
Show InChI InChI=1S/C22H26N6O3/c1-26-14-18(15-6-4-7-16(12-15)31-3)25-19(26)8-9-23-21(29)20-17(13-24-27(20)2)22(30)28-10-5-11-28/h4,6-7,12-14H,5,8-11H2,1-3H3,(H,23,29)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 38.5n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125030
PNG
(Roche-Dataset for PDE10A, Compound 49 | US8772510,...)
Show SMILES Cn1ncc(C(=O)N2CCC2)c1C(=O)NCCc1nc(nn1CC(F)(F)F)-c1ccccc1
Show InChI InChI=1S/C21H22F3N7O2/c1-29-17(15(12-26-29)20(33)30-10-5-11-30)19(32)25-9-8-16-27-18(14-6-3-2-4-7-14)28-31(16)13-21(22,23)24/h2-4,6-7,12H,5,8-11,13H2,1H3,(H,25,32)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 44.9n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125018
PNG
(US8772510, 37)
Show SMILES Cc1oc(nc1CCNC(=O)c1c(cnn1C)C(=O)N1CCOCC1)-c1ccccc1
Show InChI InChI=1S/C22H25N5O4/c1-15-18(25-21(31-15)16-6-4-3-5-7-16)8-9-23-20(28)19-17(14-24-26(19)2)22(29)27-10-12-30-13-11-27/h3-7,14H,8-13H2,1-2H3,(H,23,28)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 45.9n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125042
PNG
(Roche-Dataset for PDE10A, Compound 68 | US8772510,...)
Show SMILES CN(C1CCCC1)C(=O)c1cnn(C)c1C(=O)NCCc1nc(cn1C)-c1ccccc1
Show InChI InChI=1S/C24H30N6O2/c1-28-16-20(17-9-5-4-6-10-17)27-21(28)13-14-25-23(31)22-19(15-26-30(22)3)24(32)29(2)18-11-7-8-12-18/h4-6,9-10,15-16,18H,7-8,11-14H2,1-3H3,(H,25,31)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 54.2n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125044
PNG
(Roche-Dataset for PDE10A, Compound 363 | US8772510...)
Show SMILES Cn1cc(nc1CCNC(=O)c1c(nc(n1C)C(F)(F)F)C(=O)N1CCC1)-c1ccccc1
Show InChI InChI=1S/C22H23F3N6O2/c1-29-13-15(14-7-4-3-5-8-14)27-16(29)9-10-26-19(32)18-17(20(33)31-11-6-12-31)28-21(30(18)2)22(23,24)25/h3-5,7-8,13H,6,9-12H2,1-2H3,(H,26,32)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 56.9n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM124984
PNG
(US8772510, 3)
Show SMILES Cn1ncc(C(=O)N2CCC2)c1C(=O)NCCc1nc(no1)-c1ccccc1
Show InChI InChI=1S/C19H20N6O3/c1-24-16(14(12-21-24)19(27)25-10-5-11-25)18(26)20-9-8-15-22-17(23-28-15)13-6-3-2-4-7-13/h2-4,6-7,12H,5,8-11H2,1H3,(H,20,26)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 64n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM124993
PNG
(US8772510, 12)
Show SMILES Cn1ncc(C(=O)N2CCC2)c1C(=O)NCCn1ccc(n1)-c1ccccc1
Show InChI InChI=1S/C20H22N6O2/c1-24-18(16(14-22-24)20(28)25-10-5-11-25)19(27)21-9-13-26-12-8-17(23-26)15-6-3-2-4-7-15/h2-4,6-8,12,14H,5,9-11,13H2,1H3,(H,21,27)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 73n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125033
PNG
(Roche-Dataset for PDE10A, Compound 169 | US8772510...)
Show SMILES Cn1cc(nc1CCNC(=O)c1c(nnn1C)C(=O)N1CCC1)-c1ccccc1
Show InChI InChI=1S/C20H23N7O2/c1-25-13-15(14-7-4-3-5-8-14)22-16(25)9-10-21-19(28)18-17(23-24-26(18)2)20(29)27-11-6-12-27/h3-5,7-8,13H,6,9-12H2,1-2H3,(H,21,28)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 73.7n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125004
PNG
(US8772510, 23)
Show SMILES Cc1oc(nc1CC(C)(C)NC(=O)c1c(cnn1C)C(=O)N1CCC1)-c1ccccc1
Show InChI InChI=1S/C23H27N5O3/c1-15-18(25-21(31-15)16-9-6-5-7-10-16)13-23(2,3)26-20(29)19-17(14-24-27(19)4)22(30)28-11-8-12-28/h5-7,9-10,14H,8,11-13H2,1-4H3,(H,26,29)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 77.9n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125014
PNG
(Roche-Dataset for PDE10A, Compound 61 | US8772510,...)
Show SMILES Cc1nc(C(=O)N2CCC2)c(C(=O)NCCc2nc(cn2C)-c2ccccc2)n1C
Show InChI InChI=1S/C22H26N6O2/c1-15-24-19(22(30)28-12-7-13-28)20(27(15)3)21(29)23-11-10-18-25-17(14-26(18)2)16-8-5-4-6-9-16/h4-6,8-9,14H,7,10-13H2,1-3H3,(H,23,29)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 86n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM124982
PNG
(US8772510, 1)
Show SMILES Cn1ncc(C(=O)N2CCC2)c1C(=O)NCCc1cn2ccccc2n1
Show InChI InChI=1S/C18H20N6O2/c1-22-16(14(11-20-22)18(26)23-9-4-10-23)17(25)19-7-6-13-12-24-8-3-2-5-15(24)21-13/h2-3,5,8,11-12H,4,6-7,9-10H2,1H3,(H,19,25)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 86.6n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM124999
PNG
(US8772510, 18)
Show SMILES Cn1ncc(C(=O)N2CCC2)c1C(=O)NCCn1cnc(n1)-c1ccccc1
Show InChI InChI=1S/C19H21N7O2/c1-24-16(15(12-22-24)19(28)25-9-5-10-25)18(27)20-8-11-26-13-21-17(23-26)14-6-3-2-4-7-14/h2-4,6-7,12-13H,5,8-11H2,1H3,(H,20,27)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 110n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125025
PNG
(US8772510, 44)
Show SMILES Cc1nc(nn1CCNC(=O)c1c(cnn1C)C(=O)N1CCC1)-c1ccccc1
Show InChI InChI=1S/C20H23N7O2/c1-14-23-18(15-7-4-3-5-8-15)24-27(14)12-9-21-19(28)17-16(13-22-25(17)2)20(29)26-10-6-11-26/h3-5,7-8,13H,6,9-12H2,1-2H3,(H,21,28)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 136n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125032
PNG
(US8772510, 51)
Show SMILES Cn1ncc(C(=O)N2CCCC2)c1C(=O)NCCc1nc2ccccc2n1C
Show InChI InChI=1S/C20H24N6O2/c1-24-16-8-4-3-7-15(16)23-17(24)9-10-21-19(27)18-14(13-22-25(18)2)20(28)26-11-5-6-12-26/h3-4,7-8,13H,5-6,9-12H2,1-2H3,(H,21,27)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 145n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125035
PNG
(US8772510, 54)
Show SMILES Cc1sc(CCNC(=O)c2c(nnn2C)C(=O)N2CCC2)nc1-c1ccccc1
Show InChI InChI=1S/C20H22N6O2S/c1-13-16(14-7-4-3-5-8-14)22-15(29-13)9-10-21-19(27)18-17(23-24-25(18)2)20(28)26-11-6-12-26/h3-5,7-8H,6,9-12H2,1-2H3,(H,21,27)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 180n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM124990
PNG
(US8772510, 9)
Show SMILES Cn1ncc(C(=O)N2CCC2)c1C(=O)NCCc1nc2ccccc2s1
Show InChI InChI=1S/C18H19N5O2S/c1-22-16(12(11-20-22)18(25)23-9-4-10-23)17(24)19-8-7-15-21-13-5-2-3-6-14(13)26-15/h2-3,5-6,11H,4,7-10H2,1H3,(H,19,24)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 189n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125002
PNG
(US8772510, 21)
Show SMILES Cn1ncc(C(=O)N2CCC2)c1C(=O)NCCc1noc(n1)-c1ccccc1
Show InChI InChI=1S/C19H20N6O3/c1-24-16(14(12-21-24)19(27)25-10-5-11-25)17(26)20-9-8-15-22-18(28-23-15)13-6-3-2-4-7-13/h2-4,6-7,12H,5,8-11H2,1H3,(H,20,26)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 202n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM124996
PNG
(US8772510, 15)
Show SMILES Cn1nc(nc1CCNC(=O)c1c(cnn1C)C(=O)N1CCC1)-c1cccnc1
Show InChI InChI=1S/C19H22N8O2/c1-25-15(23-17(24-25)13-5-3-7-20-11-13)6-8-21-18(28)16-14(12-22-26(16)2)19(29)27-9-4-10-27/h3,5,7,11-12H,4,6,8-10H2,1-2H3,(H,21,28)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 207n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125000
PNG
(US8772510, 19)
Show SMILES Cn1ncc(C(=O)N2CCC2)c1C(=O)NCCc1cnn(n1)-c1ccccc1
Show InChI InChI=1S/C19H21N7O2/c1-24-17(16(13-21-24)19(28)25-10-5-11-25)18(27)20-9-8-14-12-22-26(23-14)15-6-3-2-4-7-15/h2-4,6-7,12-13H,5,8-11H2,1H3,(H,20,27)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 225n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125022
PNG
(US8772510, 41)
Show SMILES Cc1oc(nc1CCNC(=O)c1c(cnn1C)C(=O)N1CC2(COC2)C1)-c1ccccc1
Show InChI InChI=1S/C23H25N5O4/c1-15-18(26-21(32-15)16-6-4-3-5-7-16)8-9-24-20(29)19-17(10-25-27(19)2)22(30)28-11-23(12-28)13-31-14-23/h3-7,10H,8-9,11-14H2,1-2H3,(H,24,29)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 237n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125045
PNG
(US8772510, 64)
Show SMILES Cn1ncc(C(=O)N2CCC2)c1C(=O)NCCc1nc2ccccn2n1
Show InChI InChI=1S/C17H19N7O2/c1-22-15(12(11-19-22)17(26)23-8-4-9-23)16(25)18-7-6-13-20-14-5-2-3-10-24(14)21-13/h2-3,5,10-11H,4,6-9H2,1H3,(H,18,25)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 258n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125023
PNG
(US8772510, 42)
Show SMILES Cc1oc(nc1CCNC(=O)c1c(cnn1C)C(=O)N1CCSCC1)-c1ccccc1
Show InChI InChI=1S/C22H25N5O3S/c1-15-18(25-21(30-15)16-6-4-3-5-7-16)8-9-23-20(28)19-17(14-24-26(19)2)22(29)27-10-12-31-13-11-27/h3-7,14H,8-13H2,1-2H3,(H,23,28)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 260n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125015
PNG
(Roche-Dataset for PDE10A, Compound 29 | US8772510,...)
Show SMILES COCCn1nc(nc1CCNC(=O)c1c(cnn1C)C(=O)N1CCC1)-c1ccccc1
Show InChI InChI=1S/C22H27N7O3/c1-27-19(17(15-24-27)22(31)28-11-6-12-28)21(30)23-10-9-18-25-20(16-7-4-3-5-8-16)26-29(18)13-14-32-2/h3-5,7-8,15H,6,9-14H2,1-2H3,(H,23,30)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 304n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125029
PNG
(US8772510, 48)
Show SMILES CCc1cc(ccn1)-c1nc(CCNC(=O)c2c(cnn2C)C(=O)N2CCC2)c(C)s1
Show InChI InChI=1S/C22H26N6O2S/c1-4-16-12-15(6-8-23-16)21-26-18(14(2)31-21)7-9-24-20(29)19-17(13-25-27(19)3)22(30)28-10-5-11-28/h6,8,12-13H,4-5,7,9-11H2,1-3H3,(H,24,29)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 373n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM124987
PNG
(US8772510, 6)
Show SMILES Cn1ncc(C(=O)N2CCC2)c1C(=O)NCCc1nc(no1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C19H19ClN6O3/c1-25-16(14(11-22-25)19(28)26-9-2-10-26)18(27)21-8-7-15-23-17(24-29-15)12-3-5-13(20)6-4-12/h3-6,11H,2,7-10H2,1H3,(H,21,27)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 400n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125031
PNG
(US8772510, 50)
Show SMILES Cn1ncc(C(=O)N2CCOCC2)c1C(=O)NCCc1nc2ccccc2n1C
Show InChI InChI=1S/C20H24N6O3/c1-24-16-6-4-3-5-15(16)23-17(24)7-8-21-19(27)18-14(13-22-25(18)2)20(28)26-9-11-29-12-10-26/h3-6,13H,7-12H2,1-2H3,(H,21,27)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 402n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM124986
PNG
(US8772510, 5)
Show SMILES Cc1cccn2cc(CCNC(=O)c3c(cnn3C)C(=O)N3CCC3)nc12
Show InChI InChI=1S/C19H22N6O2/c1-13-5-3-8-25-12-14(22-17(13)25)6-7-20-18(26)16-15(11-21-23(16)2)19(27)24-9-4-10-24/h3,5,8,11-12H,4,6-7,9-10H2,1-2H3,(H,20,26)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 418n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM124994
PNG
(US8772510, 13)
Show SMILES Cn1c(Cl)nc(C(=O)N2CCC2)c1C(=O)NCCc1nc2ccccc2n1C
Show InChI InChI=1S/C19H21ClN6O2/c1-24-13-7-4-3-6-12(13)22-14(24)8-9-21-17(27)16-15(23-19(20)25(16)2)18(28)26-10-5-11-26/h3-4,6-7H,5,8-11H2,1-2H3,(H,21,27)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 659n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125027
PNG
(US8772510, 46)
Show SMILES Cc1sc(nc1CCNC(=O)c1c(cnn1C)C(=O)N1CCC1)-c1ccc(C)cc1
Show InChI InChI=1S/C22H25N5O2S/c1-14-5-7-16(8-6-14)21-25-18(15(2)30-21)9-10-23-20(28)19-17(13-24-26(19)3)22(29)27-11-4-12-27/h5-8,13H,4,9-12H2,1-3H3,(H,23,28)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 661n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM124995
PNG
(US8772510, 14)
Show SMILES Cn1ncc(C(=O)N2CCC2)c1C(=O)NCCc1nc(n[nH]1)-c1ccncc1
Show InChI InChI=1S/C18H20N8O2/c1-25-15(13(11-21-25)18(28)26-9-2-10-26)17(27)20-8-5-14-22-16(24-23-14)12-3-6-19-7-4-12/h3-4,6-7,11H,2,5,8-10H2,1H3,(H,20,27)(H,22,23,24)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 714n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM125006
PNG
(US8772510, 25)
Show SMILES Cn1ncc(C(=O)N2CCC2)c1C(=O)NC(C)(C)Cc1nc(no1)-c1ccccc1
Show InChI InChI=1S/C21H24N6O3/c1-21(2,12-16-23-18(25-30-16)14-8-5-4-6-9-14)24-19(28)17-15(13-22-26(17)3)20(29)27-10-7-11-27/h4-6,8-9,13H,7,10-12H2,1-3H3,(H,24,28)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 763n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM124989
PNG
(US8772510, 8)
Show SMILES Cc1nc(C(=O)N2CCOCC2)c(C(=O)NCCc2nc3ccccc3n2C)n1C
Show InChI InChI=1S/C21H26N6O3/c1-14-23-18(21(29)27-10-12-30-13-11-27)19(25(14)2)20(28)22-9-8-17-24-15-6-4-5-7-16(15)26(17)3/h4-7H,8-13H2,1-3H3,(H,22,28)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 1.09E+3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM124998
PNG
(US8772510, 17)
Show SMILES Cn1nc(nc1CCNC(=O)c1c(cnn1C)C(=O)N1CCC1)-c1ccncc1
Show InChI InChI=1S/C19H22N8O2/c1-25-15(23-17(24-25)13-4-7-20-8-5-13)6-9-21-18(28)16-14(12-22-26(16)2)19(29)27-10-3-11-27/h4-5,7-8,12H,3,6,9-11H2,1-2H3,(H,21,28)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 1.44E+3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))		BDBM124991
PNG
(US8772510, 10)
Show SMILES Cn1cnc(C(=O)N2CCC2)c1C(=O)NCCc1nc2ccccc2n1C
Show InChI InChI=1S/C19H22N6O2/c1-23-12-21-16(19(27)25-10-5-11-25)17(23)18(26)20-9-8-15-22-13-6-3-4-7-14(13)24(15)2/h3-4,6-7,12H,5,8-11H2,1-2H3,(H,20,26)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 2.25E+3n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
PDE10 activity of the compounds of the present invention was determined using a Scintillation Proximity Assay (SPA)-based method similar to the one p...

US Patent US8772510 (2014)


BindingDB Entry DOI: 10.7270/Q2MG7N67
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%