Compile Data Set for Download or QSAR
Found 13 Enz. Inhib. hit(s) with all data for entry = 50005831
TargetcAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A(Homo sapiens (Human))
Glenmark Pharmaceuticals Limited

Curated by ChEMBL
LigandPNGBDBM50494753(CHEMBL3094144)
Show SMILES Cc1nc(C)c(s1)-c1nc(C)c2sc3cc(OCc4ccc5ccccc5n4)ccc3n12
Show InChI InChI=1S/C25H20N4OS2/c1-14-23(31-16(3)26-14)24-27-15(2)25-29(24)21-11-10-19(12-22(21)32-25)30-13-18-9-8-17-6-4-5-7-20(17)28-18/h4-12H,13H2,1-3H3
Affinity DataIC50: 0.900nMAssay Description:Inhibition of human recombinant PDE10A using [3H]-cAMP/[3H]-cGMP as substrate after 30 mins by radiometric assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetcAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A(Homo sapiens (Human))
Glenmark Pharmaceuticals Limited

Curated by ChEMBL
LigandPNGBDBM50494759(CHEMBL3094141)
Show SMILES Cc1nc(-c2ccncc2)n2c3ccc(OCc4ccc5ccccc5n4)cc3sc12
Show InChI InChI=1S/C25H18N4OS/c1-16-25-29(24(27-16)18-10-12-26-13-11-18)22-9-8-20(14-23(22)31-25)30-15-19-7-6-17-4-2-3-5-21(17)28-19/h2-14H,15H2,1H3
Affinity DataIC50: 4.90nMAssay Description:Inhibition of human recombinant PDE10A using [3H]-cAMP/[3H]-cGMP as substrate after 30 mins by radiometric assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetcAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A(Homo sapiens (Human))
Glenmark Pharmaceuticals Limited

Curated by ChEMBL
LigandPNGBDBM50494752(CHEMBL3094147)
Show SMILES Cc1nc(n2c3ccc(OCc4ccc5ccccc5n4)cc3sc12)[C@@]12C[C@@H]1COC2
Show InChI InChI=1S/C25H21N3O2S/c1-15-23-28(24(26-15)25-11-17(25)12-29-14-25)21-9-8-19(10-22(21)31-23)30-13-18-7-6-16-4-2-3-5-20(16)27-18/h2-10,17H,11-14H2,1H3/t17-,25-/m1/s1
Affinity DataIC50: 5.10nMAssay Description:Inhibition of human recombinant PDE10A using [3H]-cAMP/[3H]-cGMP as substrate after 30 mins by radiometric assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetcAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A(Homo sapiens (Human))
Glenmark Pharmaceuticals Limited

Curated by ChEMBL
LigandPNGBDBM50494757(CHEMBL3094139)
Show SMILES CC(=O)N1CC(C1)c1nc(C)c2sc3cc(OCc4ccc5ccccc5n4)ccc3n12
Show InChI InChI=1S/C25H22N4O2S/c1-15-25-29(24(26-15)18-12-28(13-18)16(2)30)22-10-9-20(11-23(22)32-25)31-14-19-8-7-17-5-3-4-6-21(17)27-19/h3-11,18H,12-14H2,1-2H3
Affinity DataIC50: 6.70nMAssay Description:Inhibition of human recombinant PDE10A using [3H]-cAMP/[3H]-cGMP as substrate after 30 mins by radiometric assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetcAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A(Homo sapiens (Human))
Glenmark Pharmaceuticals Limited

Curated by ChEMBL
LigandPNGBDBM50494748(CHEMBL3094137)
Show SMILES Cc1nc(n2c3ccc(OCc4ccc5ccccc5n4)cc3sc12)[C@]12C[C@H]1COC2
Show InChI InChI=1S/C25H21N3O2S/c1-15-23-28(24(26-15)25-11-17(25)12-29-14-25)21-9-8-19(10-22(21)31-23)30-13-18-7-6-16-4-2-3-5-20(16)27-18/h2-10,17H,11-14H2,1H3/t17-,25-/m0/s1
Affinity DataIC50: 6.90nMAssay Description:Inhibition of human recombinant PDE10A using [3H]-cAMP/[3H]-cGMP as substrate after 30 mins by radiometric assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetcAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A(Homo sapiens (Human))
Glenmark Pharmaceuticals Limited

Curated by ChEMBL
LigandPNGBDBM50494758(CHEMBL3094145)
Show SMILES Cc1nc(C2CCOCC2)n2c3ccc(OCc4ccc5ccccc5n4)cc3sc12
Show InChI InChI=1S/C25H23N3O2S/c1-16-25-28(24(26-16)18-10-12-29-13-11-18)22-9-8-20(14-23(22)31-25)30-15-19-7-6-17-4-2-3-5-21(17)27-19/h2-9,14,18H,10-13,15H2,1H3
Affinity DataIC50: 7.5nMAssay Description:Inhibition of human recombinant PDE10A using [3H]-cAMP/[3H]-cGMP as substrate after 30 mins by radiometric assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetcAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A(Homo sapiens (Human))
Glenmark Pharmaceuticals Limited

Curated by ChEMBL
LigandPNGBDBM50494755(CHEMBL3094142)
Show SMILES Cc1nc(-c2ccnc(C)c2)n2c3ccc(OCc4ccc5ccccc5n4)cc3sc12
Show InChI InChI=1S/C26H20N4OS/c1-16-13-19(11-12-27-16)25-28-17(2)26-30(25)23-10-9-21(14-24(23)32-26)31-15-20-8-7-18-5-3-4-6-22(18)29-20/h3-14H,15H2,1-2H3
Affinity DataIC50: 8.70nMAssay Description:Inhibition of human recombinant PDE10A using [3H]-cAMP/[3H]-cGMP as substrate after 30 mins by radiometric assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetcAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A(Homo sapiens (Human))
Glenmark Pharmaceuticals Limited

Curated by ChEMBL
LigandPNGBDBM50494750(CHEMBL3094140)
Show SMILES CC(=O)N1CCC(CC1)c1nc(C)c2sc3cc(OCc4ccc5ccccc5n4)ccc3n12
Show InChI InChI=1S/C27H26N4O2S/c1-17-27-31(26(28-17)20-11-13-30(14-12-20)18(2)32)24-10-9-22(15-25(24)34-27)33-16-21-8-7-19-5-3-4-6-23(19)29-21/h3-10,15,20H,11-14,16H2,1-2H3
Affinity DataIC50: 9nMAssay Description:Inhibition of human recombinant PDE10A using [3H]-cAMP/[3H]-cGMP as substrate after 30 mins by radiometric assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetcAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A(Homo sapiens (Human))
Glenmark Pharmaceuticals Limited

Curated by ChEMBL
LigandPNGBDBM50494754(CHEMBL3094143)
Show SMILES Cc1nc(-c2ccnnc2)n2c3ccc(OCc4ccc5ccccc5n4)cc3sc12
Show InChI InChI=1S/C24H17N5OS/c1-15-24-29(23(27-15)17-10-11-25-26-13-17)21-9-8-19(12-22(21)31-24)30-14-18-7-6-16-4-2-3-5-20(16)28-18/h2-13H,14H2,1H3
Affinity DataIC50: 14nMAssay Description:Inhibition of human recombinant PDE10A using [3H]-cAMP/[3H]-cGMP as substrate after 30 mins by radiometric assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetcAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A(Homo sapiens (Human))
Glenmark Pharmaceuticals Limited

Curated by ChEMBL
LigandPNGBDBM50494760(CHEMBL3094146)
Show SMILES Cc1nc(C2CCOC2)n2c3ccc(OCc4ccc5ccccc5n4)cc3sc12
Show InChI InChI=1S/C24H21N3O2S/c1-15-24-27(23(25-15)17-10-11-28-13-17)21-9-8-19(12-22(21)30-24)29-14-18-7-6-16-4-2-3-5-20(16)26-18/h2-9,12,17H,10-11,13-14H2,1H3
Affinity DataIC50: 18nMAssay Description:Inhibition of human recombinant PDE10A using [3H]-cAMP/[3H]-cGMP as substrate after 30 mins by radiometric assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetcAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A(Homo sapiens (Human))
Glenmark Pharmaceuticals Limited

Curated by ChEMBL
LigandPNGBDBM50494751(CHEMBL3094138)
Show SMILES Cc1nc(C2CNC2)n2c3ccc(OCc4ccc5ccccc5n4)cc3sc12
Show InChI InChI=1S/C23H20N4OS/c1-14-23-27(22(25-14)16-11-24-12-16)20-9-8-18(10-21(20)29-23)28-13-17-7-6-15-4-2-3-5-19(15)26-17/h2-10,16,24H,11-13H2,1H3
Affinity DataIC50: 157nMAssay Description:Inhibition of human recombinant PDE10A using [3H]-cAMP/[3H]-cGMP as substrate after 30 mins by radiometric assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetcAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A(Homo sapiens (Human))
Glenmark Pharmaceuticals Limited

Curated by ChEMBL
LigandPNGBDBM50494756(CHEMBL3094135)
Show SMILES Cc1nc2sc3cc(OCc4ccc5ccccc5n4)ccc3n2c1-c1ccncc1
Show InChI InChI=1S/C25H18N4OS/c1-16-24(18-10-12-26-13-11-18)29-22-9-8-20(14-23(22)31-25(29)27-16)30-15-19-7-6-17-4-2-3-5-21(17)28-19/h2-14H,15H2,1H3
Affinity DataIC50: 351nMAssay Description:Inhibition of human recombinant PDE10A using [3H]-cAMP/[3H]-cGMP as substrate after 30 mins by radiometric assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetcAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A(Homo sapiens (Human))
Glenmark Pharmaceuticals Limited

Curated by ChEMBL
LigandPNGBDBM50494749(CHEMBL3094136)
Show SMILES C(Oc1ccc2c(c1)sc1nnc(-c3ccncc3)n21)c1ccc2ccccc2n1
Show InChI InChI=1S/C23H15N5OS/c1-2-4-19-15(3-1)5-6-17(25-19)14-29-18-7-8-20-21(13-18)30-23-27-26-22(28(20)23)16-9-11-24-12-10-16/h1-13H,14H2
Affinity DataIC50: 666nMAssay Description:Inhibition of human recombinant PDE10A using [3H]-cAMP/[3H]-cGMP as substrate after 30 mins by radiometric assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid