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Patent code US9815796

Compile Data Set for Download or QSAR

Found 1267 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
Phosphodiesterase (PDE2A3)


(Macaca mulatta (Rhesus macaque))
BDBM355246
PNG
(US9815796, Example 337)
Show SMILES CC(C)(C)[C@@H](NC(=O)c1cc(=O)[nH]c(n1)-c1ccccc1)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C23H22F3N3O2/c1-22(2,3)19(14-9-11-16(12-10-14)23(24,25)26)29-21(31)17-13-18(30)28-20(27-17)15-7-5-4-6-8-15/h4-13,19H,1-3H3,(H,29,31)(H,27,28,30)/t19-/m0/s1
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US Patent
0.400n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
3',5'-cyclic phosphodiesterase (PDE2A)


(Homo sapiens (Human))
BDBM354912
PNG
(1-Methylcyclopropanamine Oxalate | US9815796, Exam...)
Show SMILES COc1ccc(Cc2nc(cc(=O)[nH]2)C(=O)NC2(CC2)c2ccc(cc2)C(F)(F)F)cc1OC
Show InChI InChI=1S/C24H22F3N3O4/c1-33-18-8-3-14(11-19(18)34-2)12-20-28-17(13-21(31)29-20)22(32)30-23(9-10-23)15-4-6-16(7-5-15)24(25,26)27/h3-8,11,13H,9-10,12H2,1-2H3,(H,30,32)(H,28,29,31)
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0.450n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
3',5'-cyclic phosphodiesterase (PDE2A)


(Homo sapiens (Human))
BDBM355376
PNG
(N-{(1R)-2,2-dimethyl-1-[4- (trifluoromethoxy)pheny...)
Show SMILES COc1ccc(Cc2nc(cc(=O)[nH]2)C(=O)N[C@@H](c2ccc(OC(F)(F)F)cc2)C(C)(C)C)cc1
Show InChI InChI=1S/C25H26F3N3O4/c1-24(2,3)22(16-7-11-18(12-8-16)35-25(26,27)28)31-23(33)19-14-21(32)30-20(29-19)13-15-5-9-17(34-4)10-6-15/h5-12,14,22H,13H2,1-4H3,(H,31,33)(H,29,30,32)/t22-/m0/s1
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0.490n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
3',5'-cyclic phosphodiesterase (PDE2A)


(Homo sapiens (Human))
BDBM355552
PNG
(N-{(1S)-1-[2-chloro-4- (trifluoromethyl)phenyl]-2-...)
Show SMILES C[C@](CO)(NC(=O)c1cc(=O)[nH]c(n1)-c1ccccc1)c1ccc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C21H17ClF3N3O3/c1-20(11-29,14-8-7-13(9-15(14)22)21(23,24)25)28-19(31)16-10-17(30)27-18(26-16)12-5-3-2-4-6-12/h2-10,29H,11H2,1H3,(H,28,31)(H,26,27,30)/t20-/m1/s1
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0.5n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
3',5'-cyclic phosphodiesterase (PDE2A)


(Homo sapiens (Human))
BDBM355445
PNG
(N-[(1R)-1-(4-cyclopropylphenyl)- 2,2-dimethylpropy...)
Show SMILES CC(C)(C)[C@@H](NC(=O)c1cc(=O)[nH]c(n1)-c1ccccc1)c1ccc(cc1)C1CC1
Show InChI InChI=1S/C25H27N3O2/c1-25(2,3)22(18-13-11-17(12-14-18)16-9-10-16)28-24(30)20-15-21(29)27-23(26-20)19-7-5-4-6-8-19/h4-8,11-16,22H,9-10H2,1-3H3,(H,28,30)(H,26,27,29)/t22-/m0/s1
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0.510n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
3',5'-cyclic phosphodiesterase (PDE2A)


(Homo sapiens (Human))
BDBM354913
PNG
(2-Methyl-2-(1H-pyrazol-1-yl)propanimidamide acetat...)
Show SMILES COc1ccc(Cc2nc(cc(=O)[nH]2)C(=O)N[C@H](C)c2ccc(cc2)C(F)(F)F)cc1OC
Show InChI InChI=1S/C23H22F3N3O4/c1-13(15-5-7-16(8-6-15)23(24,25)26)27-22(31)17-12-21(30)29-20(28-17)11-14-4-9-18(32-2)19(10-14)33-3/h4-10,12-13H,11H2,1-3H3,(H,27,31)(H,28,29,30)/t13-/m1/s1
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0.520n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase (PDE2A3)


(Macaca mulatta (Rhesus macaque))
BDBM354912
PNG
(1-Methylcyclopropanamine Oxalate | US9815796, Exam...)
Show SMILES COc1ccc(Cc2nc(cc(=O)[nH]2)C(=O)NC2(CC2)c2ccc(cc2)C(F)(F)F)cc1OC
Show InChI InChI=1S/C24H22F3N3O4/c1-33-18-8-3-14(11-19(18)34-2)12-20-28-17(13-21(31)29-20)22(32)30-23(9-10-23)15-4-6-16(7-5-15)24(25,26)27/h3-8,11,13H,9-10,12H2,1-2H3,(H,30,32)(H,28,29,31)
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0.540n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase (PDE2A3)


(Macaca mulatta (Rhesus macaque))
BDBM354913
PNG
(2-Methyl-2-(1H-pyrazol-1-yl)propanimidamide acetat...)
Show SMILES COc1ccc(Cc2nc(cc(=O)[nH]2)C(=O)N[C@H](C)c2ccc(cc2)C(F)(F)F)cc1OC
Show InChI InChI=1S/C23H22F3N3O4/c1-13(15-5-7-16(8-6-15)23(24,25)26)27-22(31)17-12-21(30)29-20(28-17)11-14-4-9-18(32-2)19(10-14)33-3/h4-10,12-13H,11H2,1-3H3,(H,27,31)(H,28,29,30)/t13-/m1/s1
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0.560n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
3',5'-cyclic phosphodiesterase (PDE2A)


(Homo sapiens (Human))
BDBM355364
PNG
(N-{(1R)-2,2-dimethyl-1-[4- (trifluoromethyl)phenyl...)
Show SMILES COc1ccc(Cc2nc(cc(=O)[nH]2)C(=O)N[C@@H](c2ccc(cc2)C(F)(F)F)C(C)(C)C)cc1
Show InChI InChI=1S/C25H26F3N3O3/c1-24(2,3)22(16-7-9-17(10-8-16)25(26,27)28)31-23(33)19-14-21(32)30-20(29-19)13-15-5-11-18(34-4)12-6-15/h5-12,14,22H,13H2,1-4H3,(H,31,33)(H,29,30,32)/t22-/m0/s1
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0.600n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase (PDE2A3)


(Macaca mulatta (Rhesus macaque))
BDBM355373
PNG
(N-{(1R)-1-[3-fluoro-4- (trifluoromethoxy)phenyl]-2...)
Show SMILES COc1ccc(Cc2nc(cc(=O)[nH]2)C(=O)N[C@@H](c2ccc(OC(F)(F)F)c(F)c2)C(C)(C)C)cc1
Show InChI InChI=1S/C25H25F4N3O4/c1-24(2,3)22(15-7-10-19(17(26)12-15)36-25(27,28)29)32-23(34)18-13-21(33)31-20(30-18)11-14-5-8-16(35-4)9-6-14/h5-10,12-13,22H,11H2,1-4H3,(H,32,34)(H,30,31,33)/t22-/m0/s1
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0.600n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
3',5'-cyclic phosphodiesterase (PDE2A)


(Homo sapiens (Human))
BDBM355374
PNG
(N-[(1R)-2,2-dimethyl-1-{4- [(trifluoromethyl)sulfa...)
Show SMILES COc1ccc(Cc2nc(cc(=O)[nH]2)C(=O)N[C@@H](c2ccc(SC(F)(F)F)cc2)C(C)(C)C)cc1
Show InChI InChI=1S/C25H26F3N3O3S/c1-24(2,3)22(16-7-11-18(12-8-16)35-25(26,27)28)31-23(33)19-14-21(32)30-20(29-19)13-15-5-9-17(34-4)10-6-15/h5-12,14,22H,13H2,1-4H3,(H,31,33)(H,29,30,32)/t22-/m0/s1
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0.620n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase (PDE2A3)


(Macaca mulatta (Rhesus macaque))
BDBM355374
PNG
(N-[(1R)-2,2-dimethyl-1-{4- [(trifluoromethyl)sulfa...)
Show SMILES COc1ccc(Cc2nc(cc(=O)[nH]2)C(=O)N[C@@H](c2ccc(SC(F)(F)F)cc2)C(C)(C)C)cc1
Show InChI InChI=1S/C25H26F3N3O3S/c1-24(2,3)22(16-7-11-18(12-8-16)35-25(26,27)28)31-23(33)19-14-21(32)30-20(29-19)13-15-5-9-17(34-4)10-6-15/h5-12,14,22H,13H2,1-4H3,(H,31,33)(H,29,30,32)/t22-/m0/s1
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0.620n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase (PDE2A3)


(Macaca mulatta (Rhesus macaque))
BDBM355376
PNG
(N-{(1R)-2,2-dimethyl-1-[4- (trifluoromethoxy)pheny...)
Show SMILES COc1ccc(Cc2nc(cc(=O)[nH]2)C(=O)N[C@@H](c2ccc(OC(F)(F)F)cc2)C(C)(C)C)cc1
Show InChI InChI=1S/C25H26F3N3O4/c1-24(2,3)22(16-7-11-18(12-8-16)35-25(26,27)28)31-23(33)19-14-21(32)30-20(29-19)13-15-5-9-17(34-4)10-6-15/h5-12,14,22H,13H2,1-4H3,(H,31,33)(H,29,30,32)/t22-/m0/s1
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0.620n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
3',5'-cyclic phosphodiesterase (PDE2A)


(Homo sapiens (Human))
BDBM355366
PNG
(N-{(1R)-2,2-dimethyl-1-[4- (trifluoromethyl)phenyl...)
Show SMILES COc1ccc(Cc2nc(cc(=O)[nH]2)C(=O)N[C@@H](c2ccc(cc2)C(F)(F)F)C(C)(C)C)cc1F
Show InChI InChI=1S/C25H25F4N3O3/c1-24(2,3)22(15-6-8-16(9-7-15)25(27,28)29)32-23(34)18-13-21(33)31-20(30-18)12-14-5-10-19(35-4)17(26)11-14/h5-11,13,22H,12H2,1-4H3,(H,32,34)(H,30,31,33)/t22-/m0/s1
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0.640n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase (PDE2A3)


(Macaca mulatta (Rhesus macaque))
BDBM355171
PNG
(2-cyclopropyl-N-{(1R)-2,2-dimethyl- 1-[4-(trifluor...)
Show SMILES CC(C)(C)[C@@H](NC(=O)c1cc(=O)[nH]c(n1)C1CC1)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C20H22F3N3O2/c1-19(2,3)16(11-6-8-13(9-7-11)20(21,22)23)26-18(28)14-10-15(27)25-17(24-14)12-4-5-12/h6-10,12,16H,4-5H2,1-3H3,(H,26,28)(H,24,25,27)/t16-/m0/s1
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0.650n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase (PDE2A3)


(Macaca mulatta (Rhesus macaque))
BDBM355364
PNG
(N-{(1R)-2,2-dimethyl-1-[4- (trifluoromethyl)phenyl...)
Show SMILES COc1ccc(Cc2nc(cc(=O)[nH]2)C(=O)N[C@@H](c2ccc(cc2)C(F)(F)F)C(C)(C)C)cc1
Show InChI InChI=1S/C25H26F3N3O3/c1-24(2,3)22(16-7-9-17(10-8-16)25(26,27)28)31-23(33)19-14-21(32)30-20(29-19)13-15-5-11-18(34-4)12-6-15/h5-12,14,22H,13H2,1-4H3,(H,31,33)(H,29,30,32)/t22-/m0/s1
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0.680n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase (PDE2A3)


(Macaca mulatta (Rhesus macaque))
BDBM355366
PNG
(N-{(1R)-2,2-dimethyl-1-[4- (trifluoromethyl)phenyl...)
Show SMILES COc1ccc(Cc2nc(cc(=O)[nH]2)C(=O)N[C@@H](c2ccc(cc2)C(F)(F)F)C(C)(C)C)cc1F
Show InChI InChI=1S/C25H25F4N3O3/c1-24(2,3)22(15-6-8-16(9-7-15)25(27,28)29)32-23(34)18-13-21(33)31-20(30-18)12-14-5-10-19(35-4)17(26)11-14/h5-11,13,22H,12H2,1-4H3,(H,32,34)(H,30,31,33)/t22-/m0/s1
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0.680n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
3',5'-cyclic phosphodiesterase (PDE2A)


(Homo sapiens (Human))
BDBM355373
PNG
(N-{(1R)-1-[3-fluoro-4- (trifluoromethoxy)phenyl]-2...)
Show SMILES COc1ccc(Cc2nc(cc(=O)[nH]2)C(=O)N[C@@H](c2ccc(OC(F)(F)F)c(F)c2)C(C)(C)C)cc1
Show InChI InChI=1S/C25H25F4N3O4/c1-24(2,3)22(15-7-10-19(17(26)12-15)36-25(27,28)29)32-23(34)18-13-21(33)31-20(30-18)11-14-5-8-16(35-4)9-6-14/h5-10,12-13,22H,11H2,1-4H3,(H,32,34)(H,30,31,33)/t22-/m0/s1
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0.690n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase (PDE2A3)


(Macaca mulatta (Rhesus macaque))
BDBM355417
PNG
(2-(3-fluoro-4-methoxybenzyl)-N- {(1R)-1-[3-fluoro-...)
Show SMILES COc1ccc(Cc2nc(cc(=O)[nH]2)C(=O)N[C@@H](c2ccc(c(F)c2)C(F)(F)F)C(C)(C)C)cc1F
Show InChI InChI=1S/C25H24F5N3O3/c1-24(2,3)22(14-6-7-15(16(26)11-14)25(28,29)30)33-23(35)18-12-21(34)32-20(31-18)10-13-5-8-19(36-4)17(27)9-13/h5-9,11-12,22H,10H2,1-4H3,(H,33,35)(H,31,32,34)/t22-/m0/s1
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0.770n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
3',5'-cyclic phosphodiesterase (PDE2A)


(Homo sapiens (Human))
BDBM355344
PNG
(2-cyclopropyl-N-[(1R)-1-(4- cyclopropyl-3-fluoroph...)
Show SMILES CC(C)(C)[C@@H](NC(=O)c1cc(=O)[nH]c(n1)C1CC1)c1ccc(C2CC2)c(F)c1
Show InChI InChI=1S/C22H26FN3O2/c1-22(2,3)19(14-8-9-15(12-4-5-12)16(23)10-14)26-21(28)17-11-18(27)25-20(24-17)13-6-7-13/h8-13,19H,4-7H2,1-3H3,(H,26,28)(H,24,25,27)/t19-/m0/s1
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0.780n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
3',5'-cyclic phosphodiesterase (PDE2A)


(Homo sapiens (Human))
BDBM355375
PNG
(N-{(1R)-1-[3-fluoro-4- (trifluoromethyl)phenyl]-2,...)
Show SMILES COc1ccc(Cc2nc(cc(=O)[nH]2)C(=O)N[C@@H](c2ccc(c(F)c2)C(F)(F)F)C(C)(C)C)cc1
Show InChI InChI=1S/C25H25F4N3O3/c1-24(2,3)22(15-7-10-17(18(26)12-15)25(27,28)29)32-23(34)19-13-21(33)31-20(30-19)11-14-5-8-16(35-4)9-6-14/h5-10,12-13,22H,11H2,1-4H3,(H,32,34)(H,30,31,33)/t22-/m0/s1
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0.790n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
3',5'-cyclic phosphodiesterase (PDE2A)


(Homo sapiens (Human))
BDBM355171
PNG
(2-cyclopropyl-N-{(1R)-2,2-dimethyl- 1-[4-(trifluor...)
Show SMILES CC(C)(C)[C@@H](NC(=O)c1cc(=O)[nH]c(n1)C1CC1)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C20H22F3N3O2/c1-19(2,3)16(11-6-8-13(9-7-11)20(21,22)23)26-18(28)14-10-15(27)25-17(24-14)12-4-5-12/h6-10,12,16H,4-5H2,1-3H3,(H,26,28)(H,24,25,27)/t16-/m0/s1
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0.790n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
3',5'-cyclic phosphodiesterase (PDE2A)


(Homo sapiens (Human))
BDBM355415
PNG
(2-(3-fluoro-4-methoxybenzyl)-N- {(1R)-1-[3-fluoro-...)
Show SMILES COc1ccc(Cc2nc(cc(=O)[nH]2)C(=O)N[C@@H](c2ccc(OC(F)(F)F)c(F)c2)C(C)(C)C)cc1F
Show InChI InChI=1S/C25H24F5N3O4/c1-24(2,3)22(14-6-8-19(16(27)11-14)37-25(28,29)30)33-23(35)17-12-21(34)32-20(31-17)10-13-5-7-18(36-4)15(26)9-13/h5-9,11-12,22H,10H2,1-4H3,(H,33,35)(H,31,32,34)/t22-/m0/s1
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0.800n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
3',5'-cyclic phosphodiesterase (PDE2A)


(Homo sapiens (Human))
BDBM355417
PNG
(2-(3-fluoro-4-methoxybenzyl)-N- {(1R)-1-[3-fluoro-...)
Show SMILES COc1ccc(Cc2nc(cc(=O)[nH]2)C(=O)N[C@@H](c2ccc(c(F)c2)C(F)(F)F)C(C)(C)C)cc1F
Show InChI InChI=1S/C25H24F5N3O3/c1-24(2,3)22(14-6-7-15(16(26)11-14)25(28,29)30)33-23(35)18-12-21(34)32-20(31-18)10-13-5-8-19(36-4)17(27)9-13/h5-9,11-12,22H,10H2,1-4H3,(H,33,35)(H,31,32,34)/t22-/m0/s1
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0.800n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
3',5'-cyclic phosphodiesterase (PDE2A)


(Homo sapiens (Human))
BDBM355372
PNG
(2-cyclopropyl-N-{(1R)-2,2- dimethyl-1-[4- (trifluo...)
Show SMILES CC(C)(C)[C@@H](NC(=O)c1cc(=O)[nH]c(n1)C1CC1)c1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C20H22F3N3O3/c1-19(2,3)16(11-6-8-13(9-7-11)29-20(21,22)23)26-18(28)14-10-15(27)25-17(24-14)12-4-5-12/h6-10,12,16H,4-5H2,1-3H3,(H,26,28)(H,24,25,27)/t16-/m0/s1
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0.840n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase (PDE2A3)


(Macaca mulatta (Rhesus macaque))
BDBM355171
PNG
(2-cyclopropyl-N-{(1R)-2,2-dimethyl- 1-[4-(trifluor...)
Show SMILES CC(C)(C)[C@@H](NC(=O)c1cc(=O)[nH]c(n1)C1CC1)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C20H22F3N3O2/c1-19(2,3)16(11-6-8-13(9-7-11)20(21,22)23)26-18(28)14-10-15(27)25-17(24-14)12-4-5-12/h6-10,12,16H,4-5H2,1-3H3,(H,26,28)(H,24,25,27)/t16-/m0/s1
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0.850n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase (PDE2A3)


(Macaca mulatta (Rhesus macaque))
BDBM355375
PNG
(N-{(1R)-1-[3-fluoro-4- (trifluoromethyl)phenyl]-2,...)
Show SMILES COc1ccc(Cc2nc(cc(=O)[nH]2)C(=O)N[C@@H](c2ccc(c(F)c2)C(F)(F)F)C(C)(C)C)cc1
Show InChI InChI=1S/C25H25F4N3O3/c1-24(2,3)22(15-7-10-17(18(26)12-15)25(27,28)29)32-23(34)19-13-21(33)31-20(30-19)11-14-5-8-16(35-4)9-6-14/h5-10,12-13,22H,11H2,1-4H3,(H,32,34)(H,30,31,33)/t22-/m0/s1
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0.850n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
3',5'-cyclic phosphodiesterase (PDE2A)


(Homo sapiens (Human))
BDBM355382
PNG
(N-{(1R)-1-[3-fluoro-4- (trifluoromethoxy)phenyl]-2...)
Show SMILES COc1ccc(Cc2nc(cc(=O)[nH]2)C(=O)N[C@H](C(C)C)c2ccc(OC(F)(F)F)c(F)c2)cc1
Show InChI InChI=1S/C24H23F4N3O4/c1-13(2)22(15-6-9-19(17(25)11-15)35-24(26,27)28)31-23(33)18-12-21(32)30-20(29-18)10-14-4-7-16(34-3)8-5-14/h4-9,11-13,22H,10H2,1-3H3,(H,31,33)(H,29,30,32)/t22-/m1/s1
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0.860n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase (PDE2A3)


(Macaca mulatta (Rhesus macaque))
BDBM355418
PNG
(N-{(1R)-2,2-dimethyl-1-[4- (trifluoromethoxy)pheny...)
Show SMILES COc1ccc(Cc2nc(cc(=O)[nH]2)C(=O)N[C@@H](c2ccc(OC(F)(F)F)cc2)C(C)(C)C)cc1F
Show InChI InChI=1S/C25H25F4N3O4/c1-24(2,3)22(15-6-8-16(9-7-15)36-25(27,28)29)32-23(34)18-13-21(33)31-20(30-18)12-14-5-10-19(35-4)17(26)11-14/h5-11,13,22H,12H2,1-4H3,(H,32,34)(H,30,31,33)/t22-/m0/s1
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0.880n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
3',5'-cyclic phosphodiesterase (PDE2A)


(Homo sapiens (Human))
BDBM355378
PNG
(2-(4-methoxybenzyl)-N-[(1R)-2- methyl-1-{4- [(trif...)
Show SMILES COc1ccc(Cc2nc(cc(=O)[nH]2)C(=O)N[C@H](C(C)C)c2ccc(SC(F)(F)F)cc2)cc1
Show InChI InChI=1S/C24H24F3N3O3S/c1-14(2)22(16-6-10-18(11-7-16)34-24(25,26)27)30-23(32)19-13-21(31)29-20(28-19)12-15-4-8-17(33-3)9-5-15/h4-11,13-14,22H,12H2,1-3H3,(H,30,32)(H,28,29,31)/t22-/m1/s1
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0.910n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase (PDE2A3)


(Macaca mulatta (Rhesus macaque))
BDBM355415
PNG
(2-(3-fluoro-4-methoxybenzyl)-N- {(1R)-1-[3-fluoro-...)
Show SMILES COc1ccc(Cc2nc(cc(=O)[nH]2)C(=O)N[C@@H](c2ccc(OC(F)(F)F)c(F)c2)C(C)(C)C)cc1F
Show InChI InChI=1S/C25H24F5N3O4/c1-24(2,3)22(14-6-8-19(16(27)11-14)37-25(28,29)30)33-23(35)17-12-21(34)32-20(31-17)10-13-5-7-18(36-4)15(26)9-13/h5-9,11-12,22H,10H2,1-4H3,(H,33,35)(H,31,32,34)/t22-/m0/s1
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0.920n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase (PDE2A3)


(Macaca mulatta (Rhesus macaque))
BDBM355378
PNG
(2-(4-methoxybenzyl)-N-[(1R)-2- methyl-1-{4- [(trif...)
Show SMILES COc1ccc(Cc2nc(cc(=O)[nH]2)C(=O)N[C@H](C(C)C)c2ccc(SC(F)(F)F)cc2)cc1
Show InChI InChI=1S/C24H24F3N3O3S/c1-14(2)22(16-6-10-18(11-7-16)34-24(25,26)27)30-23(32)19-13-21(31)29-20(28-19)12-15-4-8-17(33-3)9-5-15/h4-11,13-14,22H,12H2,1-3H3,(H,30,32)(H,28,29,31)/t22-/m1/s1
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0.960n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase (PDE2A3)


(Macaca mulatta (Rhesus macaque))
BDBM355153
PNG
(2-cyclopropyl-N-[(1R)-1-{3-fluoro-4- [(trifluorome...)
Show SMILES CC(C)[C@@H](NC(=O)c1cc(=O)[nH]c(n1)C1CC1)c1ccc(SC(F)(F)F)c(F)c1
Show InChI InChI=1S/C19H19F4N3O2S/c1-9(2)16(11-5-6-14(12(20)7-11)29-19(21,22)23)26-18(28)13-8-15(27)25-17(24-13)10-3-4-10/h5-10,16H,3-4H2,1-2H3,(H,26,28)(H,24,25,27)/t16-/m1/s1
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0.990n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
3',5'-cyclic phosphodiesterase (PDE2A)


(Homo sapiens (Human))
BDBM355418
PNG
(N-{(1R)-2,2-dimethyl-1-[4- (trifluoromethoxy)pheny...)
Show SMILES COc1ccc(Cc2nc(cc(=O)[nH]2)C(=O)N[C@@H](c2ccc(OC(F)(F)F)cc2)C(C)(C)C)cc1F
Show InChI InChI=1S/C25H25F4N3O4/c1-24(2,3)22(15-6-8-16(9-7-15)36-25(27,28)29)32-23(34)18-13-21(33)31-20(30-18)12-14-5-10-19(35-4)17(26)11-14/h5-11,13,22H,12H2,1-4H3,(H,32,34)(H,30,31,33)/t22-/m0/s1
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0.990n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
3',5'-cyclic phosphodiesterase (PDE2A)


(Homo sapiens (Human))
BDBM355416
PNG
(N-[(1R)-2,2-dimethyl-1-{4- [(trifluoromethyl)sulfa...)
Show SMILES COc1ccc(Cc2nc(cc(=O)[nH]2)C(=O)N[C@@H](c2ccc(SC(F)(F)F)cc2)C(C)(C)C)cc1F
Show InChI InChI=1S/C25H25F4N3O3S/c1-24(2,3)22(15-6-8-16(9-7-15)36-25(27,28)29)32-23(34)18-13-21(33)31-20(30-18)12-14-5-10-19(35-4)17(26)11-14/h5-11,13,22H,12H2,1-4H3,(H,32,34)(H,30,31,33)/t22-/m0/s1
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1n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase (PDE2A3)


(Macaca mulatta (Rhesus macaque))
BDBM355348
PNG
(2-cyclopropyl-N-[(1R)-2,2-dimethyl- 1-{4- [(triflu...)
Show SMILES CC(C)(C)[C@@H](NC(=O)c1cc(=O)[nH]c(n1)C1CC1)c1ccc(SC(F)(F)F)cc1
Show InChI InChI=1S/C20H22F3N3O2S/c1-19(2,3)16(11-6-8-13(9-7-11)29-20(21,22)23)26-18(28)14-10-15(27)25-17(24-14)12-4-5-12/h6-10,12,16H,4-5H2,1-3H3,(H,26,28)(H,24,25,27)/t16-/m0/s1
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1n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase (PDE2A3)


(Macaca mulatta (Rhesus macaque))
BDBM355169
PNG
(N-[(1R)-1-{3-fluoro-4- [(trifluoromethyl)sulfanyl]...)
Show SMILES C[C@@H](NC(=O)c1cc(=O)[nH]c(n1)-c1ncccn1)c1ccc(SC(F)(F)F)c(F)c1
Show InChI InChI=1S/C18H13F4N5O2S/c1-9(10-3-4-13(11(19)7-10)30-18(20,21)22)25-17(29)12-8-14(28)27-16(26-12)15-23-5-2-6-24-15/h2-9H,1H3,(H,25,29)(H,26,27,28)/t9-/m1/s1
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1n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
3',5'-cyclic phosphodiesterase (PDE2A)


(Homo sapiens (Human))
BDBM355424
PNG
(2-(3-fluoro-4-methoxybenzyl)-N- {(1R)-1-[3-fluoro-...)
Show SMILES COc1ccc(Cc2nc(cc(=O)[nH]2)C(=O)N[C@H](C(C)C)c2ccc(OC(F)(F)F)c(F)c2)cc1F
Show InChI InChI=1S/C24H22F5N3O4/c1-12(2)22(14-5-7-19(16(26)10-14)36-24(27,28)29)32-23(34)17-11-21(33)31-20(30-17)9-13-4-6-18(35-3)15(25)8-13/h4-8,10-12,22H,9H2,1-3H3,(H,32,34)(H,30,31,33)/t22-/m1/s1
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1n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
3',5'-cyclic phosphodiesterase (PDE2A)


(Homo sapiens (Human))
BDBM355437
PNG
(2-(3-fluoro-4-methoxybenzyl)-N- {(1R)-1-[3-fluoro-...)
Show SMILES CC[C@@H](NC(=O)c1cc(=O)[nH]c(Cc2ccc(OC)c(F)c2)n1)c1ccc(OC(F)(F)F)c(F)c1
Show InChI InChI=1S/C23H20F5N3O4/c1-3-16(13-5-7-19(15(25)10-13)35-23(26,27)28)30-22(33)17-11-21(32)31-20(29-17)9-12-4-6-18(34-2)14(24)8-12/h4-8,10-11,16H,3,9H2,1-2H3,(H,30,33)(H,29,31,32)/t16-/m1/s1
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1.10n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
3',5'-cyclic phosphodiesterase (PDE2A)


(Homo sapiens (Human))
BDBM355246
PNG
(US9815796, Example 337)
Show SMILES CC(C)(C)[C@@H](NC(=O)c1cc(=O)[nH]c(n1)-c1ccccc1)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C23H22F3N3O2/c1-22(2,3)19(14-9-11-16(12-10-14)23(24,25)26)29-21(31)17-13-18(30)28-20(27-17)15-7-5-4-6-8-15/h4-13,19H,1-3H3,(H,29,31)(H,27,28,30)/t19-/m0/s1
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1.10n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase (PDE2A3)


(Macaca mulatta (Rhesus macaque))
BDBM355382
PNG
(N-{(1R)-1-[3-fluoro-4- (trifluoromethoxy)phenyl]-2...)
Show SMILES COc1ccc(Cc2nc(cc(=O)[nH]2)C(=O)N[C@H](C(C)C)c2ccc(OC(F)(F)F)c(F)c2)cc1
Show InChI InChI=1S/C24H23F4N3O4/c1-13(2)22(15-6-9-19(17(25)11-15)35-24(26,27)28)31-23(33)18-12-21(32)30-20(29-18)10-14-4-7-16(34-3)8-5-14/h4-9,11-13,22H,10H2,1-3H3,(H,31,33)(H,29,30,32)/t22-/m1/s1
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1.10n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase (PDE2A3)


(Macaca mulatta (Rhesus macaque))
BDBM355416
PNG
(N-[(1R)-2,2-dimethyl-1-{4- [(trifluoromethyl)sulfa...)
Show SMILES COc1ccc(Cc2nc(cc(=O)[nH]2)C(=O)N[C@@H](c2ccc(SC(F)(F)F)cc2)C(C)(C)C)cc1F
Show InChI InChI=1S/C25H25F4N3O3S/c1-24(2,3)22(15-6-8-16(9-7-15)36-25(27,28)29)32-23(34)18-13-21(33)31-20(30-18)12-14-5-10-19(35-4)17(26)11-14/h5-11,13,22H,12H2,1-4H3,(H,32,34)(H,30,31,33)/t22-/m0/s1
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1.10n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase (PDE2A3)


(Macaca mulatta (Rhesus macaque))
BDBM355424
PNG
(2-(3-fluoro-4-methoxybenzyl)-N- {(1R)-1-[3-fluoro-...)
Show SMILES COc1ccc(Cc2nc(cc(=O)[nH]2)C(=O)N[C@H](C(C)C)c2ccc(OC(F)(F)F)c(F)c2)cc1F
Show InChI InChI=1S/C24H22F5N3O4/c1-12(2)22(14-5-7-19(16(26)10-14)36-24(27,28)29)32-23(34)17-11-21(33)31-20(30-17)9-13-4-6-18(35-3)15(25)8-13/h4-8,10-12,22H,9H2,1-3H3,(H,32,34)(H,30,31,33)/t22-/m1/s1
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1.10n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase (PDE2A3)


(Macaca mulatta (Rhesus macaque))
BDBM355344
PNG
(2-cyclopropyl-N-[(1R)-1-(4- cyclopropyl-3-fluoroph...)
Show SMILES CC(C)(C)[C@@H](NC(=O)c1cc(=O)[nH]c(n1)C1CC1)c1ccc(C2CC2)c(F)c1
Show InChI InChI=1S/C22H26FN3O2/c1-22(2,3)19(14-8-9-15(12-4-5-12)16(23)10-14)26-21(28)17-11-18(27)25-20(24-17)13-6-7-13/h8-13,19H,4-7H2,1-3H3,(H,26,28)(H,24,25,27)/t19-/m0/s1
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1.10n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
3',5'-cyclic phosphodiesterase (PDE2A)


(Homo sapiens (Human))
BDBM355454
PNG
(N-{(1R)-1-[2-fluoro-4- (trifluoromethyl)phenyl]-2,...)
Show SMILES CC(C)(C)[C@@H](NC(=O)c1cc(=O)[nH]c(n1)-c1ccccc1)c1ccc(cc1F)C(F)(F)F
Show InChI InChI=1S/C23H21F4N3O2/c1-22(2,3)19(15-10-9-14(11-16(15)24)23(25,26)27)30-21(32)17-12-18(31)29-20(28-17)13-7-5-4-6-8-13/h4-12,19H,1-3H3,(H,30,32)(H,28,29,31)/t19-/m0/s1
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1.20n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase (PDE2A3)


(Macaca mulatta (Rhesus macaque))
BDBM355437
PNG
(2-(3-fluoro-4-methoxybenzyl)-N- {(1R)-1-[3-fluoro-...)
Show SMILES CC[C@@H](NC(=O)c1cc(=O)[nH]c(Cc2ccc(OC)c(F)c2)n1)c1ccc(OC(F)(F)F)c(F)c1
Show InChI InChI=1S/C23H20F5N3O4/c1-3-16(13-5-7-19(15(25)10-13)35-23(26,27)28)30-22(33)17-11-21(32)31-20(29-17)9-12-4-6-18(34-2)14(24)8-12/h4-8,10-11,16H,3,9H2,1-2H3,(H,30,33)(H,29,31,32)/t16-/m1/s1
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1.20n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
3',5'-cyclic phosphodiesterase (PDE2A)


(Homo sapiens (Human))
BDBM355100
PNG
(2-cyclopropyl-N-{(1R)-2-methyl-1-[4- (trifluoromet...)
Show SMILES CC(C)[C@@H](NC(=O)c1cc(=O)[nH]c(n1)C1CC1)c1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C19H20F3N3O3/c1-10(2)16(11-5-7-13(8-6-11)28-19(20,21)22)25-18(27)14-9-15(26)24-17(23-14)12-3-4-12/h5-10,12,16H,3-4H2,1-2H3,(H,25,27)(H,23,24,26)/t16-/m1/s1
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1.20n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase (PDE2A3)


(Macaca mulatta (Rhesus macaque))
BDBM355379
PNG
(N-[(1R)-1-{3-fluoro-4- [(trifluoromethyl)sulfanyl]...)
Show SMILES COc1ccc(Cc2nc(cc(=O)[nH]2)C(=O)N[C@H](C(C)C)c2ccc(SC(F)(F)F)c(F)c2)cc1
Show InChI InChI=1S/C24H23F4N3O3S/c1-13(2)22(15-6-9-19(17(25)11-15)35-24(26,27)28)31-23(33)18-12-21(32)30-20(29-18)10-14-4-7-16(34-3)8-5-14/h4-9,11-13,22H,10H2,1-3H3,(H,31,33)(H,29,30,32)/t22-/m1/s1
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1.20n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
Phosphodiesterase (PDE2A3)


(Macaca mulatta (Rhesus macaque))
BDBM355372
PNG
(2-cyclopropyl-N-{(1R)-2,2- dimethyl-1-[4- (trifluo...)
Show SMILES CC(C)(C)[C@@H](NC(=O)c1cc(=O)[nH]c(n1)C1CC1)c1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C20H22F3N3O3/c1-19(2,3)16(11-6-8-13(9-7-11)29-20(21,22)23)26-18(28)14-10-15(27)25-17(24-14)12-4-5-12/h6-10,12,16H,4-5H2,1-3H3,(H,26,28)(H,24,25,27)/t16-/m0/s1
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1.20n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
3',5'-cyclic phosphodiesterase (PDE2A)


(Homo sapiens (Human))
BDBM355346
PNG
(2-cyclopropyl-N-{(1R)-1-[3-fluoro-4- (trifluoromet...)
Show SMILES CC(C)(C)[C@@H](NC(=O)c1cc(=O)[nH]c(n1)C1CC1)c1ccc(OC(F)(F)F)c(F)c1
Show InChI InChI=1S/C20H21F4N3O3/c1-19(2,3)16(11-6-7-14(12(21)8-11)30-20(22,23)24)27-18(29)13-9-15(28)26-17(25-13)10-4-5-10/h6-10,16H,4-5H2,1-3H3,(H,27,29)(H,25,26,28)/t16-/m0/s1
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1.20n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp.; MSD R & D (China) Co. LTD.

US Patent


Assay Description
In a typical experiment the PDE2 inhibitory activity of the compounds of the present invention was determined in accordance with the following experi...


US Patent US9815796 (2017)

More data for this
Ligand-Target Pair
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