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Patent code US9540379

Compile Data Set for Download or QSAR

Found 222 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))
BDBM204680
PNG
(1-(2-chloro-phenyl)-4-methyl-7-(quinolin-2-ylmetho...)
Show SMILES Cc1nc2cc(OCc3ccc4ccccc4n3)ccc2n2c(nnc12)-c1ccccc1Cl
Show InChI InChI=1S/C26H18ClN5O/c1-16-25-30-31-26(20-7-3-4-8-21(20)27)32(25)24-13-12-19(14-23(24)28-16)33-15-18-11-10-17-6-2-5-9-22(17)29-18/h2-14H,15H2,1H3
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n/an/a 1n/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA of PDE10A1 (AB 020593, 2340 bp) was synthesized and cloned into the vector pCR4. TOPO (Entelechon GmbH, Regensburg, Germany). The gene was th...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204147
PNG
(1-(5-butoxy-2-chloro-phenyl)-8-chloro-4-methyl-[1,...)
Show SMILES CCCCOc1ccc(Cl)c(c1)-c1nnc2c(C)nc3ccc(Cl)cc3n12
Show InChI InChI=1S/C20H18Cl2N4O/c1-3-4-9-27-14-6-7-16(22)15(11-14)20-25-24-19-12(2)23-17-8-5-13(21)10-18(17)26(19)20/h5-8,10-11H,3-4,9H2,1-2H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204684
PNG
(8-bromo-1-(5-butoxy-2-chloro-phenyl)-4-methyl-[1,2...)
Show SMILES CCCCOc1ccc(Cl)c(c1)-c1nnc2c(C)nc3ccc(Br)cc3n12
Show InChI InChI=1S/C20H18BrClN4O/c1-3-4-9-27-14-6-7-16(22)15(11-14)20-25-24-19-12(2)23-17-8-5-13(21)10-18(17)26(19)20/h5-8,10-11H,3-4,9H2,1-2H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204680
PNG
(1-(2-chloro-phenyl)-4-methyl-7-(quinolin-2-ylmetho...)
Show SMILES Cc1nc2cc(OCc3ccc4ccccc4n3)ccc2n2c(nnc12)-c1ccccc1Cl
Show InChI InChI=1S/C26H18ClN5O/c1-16-25-30-31-26(20-7-3-4-8-21(20)27)32(25)24-13-12-19(14-23(24)28-16)33-15-18-11-10-17-6-2-5-9-22(17)29-18/h2-14H,15H2,1H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204718
PNG
(4-chloro-3-(8-chloro-4-methyl-[1,2,4]triazolo[4,3-...)
Show SMILES Cc1nc2ccc(Cl)cc2n2c(nnc12)-c1cc(O)ccc1Cl
Show InChI InChI=1S/C16H10Cl2N4O/c1-8-15-20-21-16(11-7-10(23)3-4-12(11)18)22(15)14-6-9(17)2-5-13(14)19-8/h2-7,23H,1H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204682
PNG
(8-bromo-1-(2-chloro-phenyl)-4-methy[1,2,4]triazolo...)
Show SMILES Cc1nc2ccc(Br)cc2n2c(nnc12)-c1ccccc1Cl
Show InChI InChI=1S/C16H10BrClN4/c1-9-15-20-21-16(11-4-2-3-5-12(11)18)22(15)14-8-10(17)6-7-13(14)19-9/h2-8H,1H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204665
PNG
(1-(5-butoxy-2-fluoro-phenyl)-4-methyl-8-trifluorom...)
Show SMILES CCCCOc1ccc(F)c(c1)-c1nnc2c(C)nc3ccc(cc3n12)C(F)(F)F
Show InChI InChI=1S/C21H18F4N4O/c1-3-4-9-30-14-6-7-16(22)15(11-14)20-28-27-19-12(2)26-17-8-5-13(21(23,24)25)10-18(17)29(19)20/h5-8,10-11H,3-4,9H2,1-2H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204681
PNG
(1-(2-chloro-phenyl)-4-methyl-8-(quinolin-2-ylmetho...)
Show SMILES Cc1nc2ccc(OCc3ccc4ccccc4n3)cc2n2c(nnc12)-c1ccccc1Cl
Show InChI InChI=1S/C26H18ClN5O/c1-16-25-30-31-26(20-7-3-4-8-21(20)27)32(25)24-14-19(12-13-23(24)28-16)33-15-18-11-10-17-6-2-5-9-22(17)29-18/h2-14H,15H2,1H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204136
PNG
(8-Chloro-1-(2-chloro-phenyl)-4-methyl-[1,2,4]triaz...)
Show SMILES Cc1nc2ccc(Cl)cc2n2c(nnc12)-c1ccccc1Cl
Show InChI InChI=1S/C16H10Cl2N4/c1-9-15-20-21-16(11-4-2-3-5-12(11)18)22(15)14-8-10(17)6-7-13(14)19-9/h2-8H,1H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204627
PNG
(1-(5-butoxy-2-chloro-phenyl)-4-methyl-[1,2,4]triaz...)
Show SMILES CCCCOc1ccc(Cl)c(c1)-c1nnc2c(C)nc3ccccc3n12
Show InChI InChI=1S/C20H19ClN4O/c1-3-4-11-26-14-9-10-16(21)15(12-14)20-24-23-19-13(2)22-17-7-5-6-8-18(17)25(19)20/h5-10,12H,3-4,11H2,1-2H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204686
PNG
(8-bromo-1-(5-butoxy-2-fluoro-phenyl)-4-methyl-[1,2...)
Show SMILES CCCCOc1ccc(F)c(c1)-c1nnc2c(C)nc3ccc(Br)cc3n12
Show InChI InChI=1S/C20H18BrFN4O/c1-3-4-9-27-14-6-7-16(22)15(11-14)20-25-24-19-12(2)23-17-8-5-13(21)10-18(17)26(19)20/h5-8,10-11H,3-4,9H2,1-2H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204655
PNG
(1-(2-chloro-phenyl)-4-methyl-8-trifluoromethyl-[1,...)
Show SMILES Cc1nc2ccc(cc2n2c(nnc12)-c1ccccc1Cl)C(F)(F)F
Show InChI InChI=1S/C17H10ClF3N4/c1-9-15-23-24-16(11-4-2-3-5-12(11)18)25(15)14-8-10(17(19,20)21)6-7-13(14)22-9/h2-8H,1H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204149
PNG
(1-(5-butoxy-2-methyl-phenyl)-8-chloro-4-methyl-[1,...)
Show SMILES CCCCOc1ccc(C)c(c1)-c1nnc2c(C)nc3ccc(Cl)cc3n12
Show InChI InChI=1S/C21H21ClN4O/c1-4-5-10-27-16-8-6-13(2)17(12-16)21-25-24-20-14(3)23-18-9-7-15(22)11-19(18)26(20)21/h6-9,11-12H,4-5,10H2,1-3H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204640
PNG
(4-chloro-3-(4-methyl-[1,2,4]triazolo[4,3-a]quinoxa...)
Show SMILES Cc1nc2ccccc2n2c(nnc12)-c1cc(O)ccc1Cl
Show InChI InChI=1S/C16H11ClN4O/c1-9-15-19-20-16(11-8-10(22)6-7-12(11)17)21(15)14-5-3-2-4-13(14)18-9/h2-8,22H,1H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204146
PNG
(1-(5-butoxy-2-fluoro-phenyl)-8-chloro-4-methyl-[1,...)
Show SMILES CCCCOc1ccc(F)c(c1)-c1nnc2c(C)nc3ccc(Cl)cc3n12
Show InChI InChI=1S/C20H18ClFN4O/c1-3-4-9-27-14-6-7-16(22)15(11-14)20-25-24-19-12(2)23-17-8-5-13(21)10-18(17)26(19)20/h5-8,10-11H,3-4,9H2,1-2H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204725
PNG
(1-[2-chloro-5-(4,4,4,-trifluoro-butoxy)-phenyl]-4,...)
Show SMILES Cc1ccc2nc(C)c3nnc(-c4cc(OCCCC(F)(F)F)ccc4Cl)n3c2c1
Show InChI InChI=1S/C21H18ClF3N4O/c1-12-4-7-17-18(10-12)29-19(13(2)26-17)27-28-20(29)15-11-14(5-6-16(15)22)30-9-3-8-21(23,24)25/h4-7,10-11H,3,8-9H2,1-2H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204704
PNG
(3-[4-chloro-3-(8-chloro-4-methyl-[1,2,4]triazolo[4...)
Show SMILES Cc1nc2ccc(Cl)cc2n2c(nnc12)-c1cc(OCCCO)ccc1Cl
Show InChI InChI=1S/C19H16Cl2N4O2/c1-11-18-23-24-19(25(18)17-9-12(20)3-6-16(17)22-11)14-10-13(4-5-15(14)21)27-8-2-7-26/h3-6,9-10,26H,2,7-8H2,1H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204141
PNG
(8-chloro-1-(2,5-dichloro-phenyl)-4-methyl-[1,2,4]t...)
Show SMILES Cc1nc2ccc(Cl)cc2n2c(nnc12)-c1cc(Cl)ccc1Cl
Show InChI InChI=1S/C16H9Cl3N4/c1-8-15-21-22-16(11-6-9(17)2-4-12(11)19)23(15)14-7-10(18)3-5-13(14)20-8/h2-7H,1H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204621
PNG
(1-(2-chloro-6-fluoro-phenyl)-4-methyl-[1,2,4]triaz...)
Show SMILES Cc1nc2ccccc2n2c(nnc12)-c1c(F)cccc1Cl
Show InChI InChI=1S/C16H10ClFN4/c1-9-15-20-21-16(14-10(17)5-4-6-11(14)18)22(15)13-8-3-2-7-12(13)19-9/h2-8H,1H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204142
PNG
(8-chloro-1-(2-chloro-5-methoxy-phenyl)-4-methyl-[1...)
Show SMILES COc1ccc(Cl)c(c1)-c1nnc2c(C)nc3ccc(Cl)cc3n12
Show InChI InChI=1S/C17H12Cl2N4O/c1-9-16-21-22-17(12-8-11(24-2)4-5-13(12)19)23(16)15-7-10(18)3-6-14(15)20-9/h3-8H,1-2H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM50085693
PNG
(CHEMBL1915969 | US9540379, 32)
Show SMILES Cc1nc2ccccc2n2c(nnc12)-c1ccccc1Cl
Show InChI InChI=1S/C16H11ClN4/c1-10-15-19-20-16(11-6-2-3-7-12(11)17)21(15)14-9-5-4-8-13(14)18-10/h2-9H,1H3
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Article
US Patent
n/an/a 5n/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204653
PNG
(1-(5-butoxy-2-chloro-phenyl)-8-fluoro-4-methyl-[1,...)
Show SMILES CCCCOc1ccc(Cl)c(c1)-c1nnc2c(C)nc3ccc(F)cc3n12
Show InChI InChI=1S/C20H18ClFN4O/c1-3-4-9-27-14-6-7-16(21)15(11-14)20-25-24-19-12(2)23-17-8-5-13(22)10-18(17)26(19)20/h5-8,10-11H,3-4,9H2,1-2H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204638
PNG
(1-(2-chloro-5-cyclopropylmethoxy-phenyl)-4-methyl-...)
Show SMILES Cc1nc2ccccc2n2c(nnc12)-c1cc(OCC2CC2)ccc1Cl
Show InChI InChI=1S/C20H17ClN4O/c1-12-19-23-24-20(25(19)18-5-3-2-4-17(18)22-12)15-10-14(8-9-16(15)21)26-11-13-6-7-13/h2-5,8-10,13H,6-7,11H2,1H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204632
PNG
(1-[2-chloro-5-(4,4,4-trifluoro-butoxy)-phenyl]-4-m...)
Show SMILES Cc1nc2ccccc2n2c(nnc12)-c1cc(OCCCC(F)(F)F)ccc1Cl
Show InChI InChI=1S/C20H16ClF3N4O/c1-12-18-26-27-19(28(18)17-6-3-2-5-16(17)25-12)14-11-13(7-8-15(14)21)29-10-4-9-20(22,23)24/h2-3,5-8,11H,4,9-10H2,1H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204637
PNG
(1-(2-chloro-5-cyclobutylmethoxy-phenyl)-4-methyl-[...)
Show SMILES Cc1nc2ccccc2n2c(nnc12)-c1cc(OCC2CCC2)ccc1Cl
Show InChI InChI=1S/C21H19ClN4O/c1-13-20-24-25-21(26(20)19-8-3-2-7-18(19)23-13)16-11-15(9-10-17(16)22)27-12-14-5-4-6-14/h2-3,7-11,14H,4-6,12H2,1H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204676
PNG
(1-(2-chloro-phenyl)-4-methyl-[1,2,4]triazolo[4,3-a...)
Show SMILES Cc1nc2cc(O)ccc2n2c(nnc12)-c1ccccc1Cl
Show InChI InChI=1S/C16H11ClN4O/c1-9-15-19-20-16(11-4-2-3-5-12(11)17)21(15)14-7-6-10(22)8-13(14)18-9/h2-8,22H,1H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204678
PNG
(1-(2-chloro-phenyl)-7-(4-fluoro-benzyloxy)-4-methy...)
Show SMILES Cc1nc2cc(Oc3ccc(F)cc3)ccc2n2c(nnc12)-c1ccccc1Cl
Show InChI InChI=1S/C22H14ClFN4O/c1-13-21-26-27-22(17-4-2-3-5-18(17)23)28(21)20-11-10-16(12-19(20)25-13)29-15-8-6-14(24)7-9-15/h2-12H,1H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204626
PNG
(1-(5-butoxy-2-fluoro-phenyl)-4-methyl-[1,2,4]triaz...)
Show SMILES CCCCOc1ccc(F)c(c1)-c1nnc2c(C)nc3ccccc3n12
Show InChI InChI=1S/C20H19FN4O/c1-3-4-11-26-14-9-10-16(21)15(12-14)20-24-23-19-13(2)22-17-7-5-6-8-18(17)25(19)20/h5-10,12H,3-4,11H2,1-2H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204705
PNG
(1-[4-chloro-3-(8-chloro-4-methyl-[1,2,4]triazolo[4...)
Show SMILES CC(O)COc1ccc(Cl)c(c1)-c1nnc2c(C)nc3ccc(Cl)cc3n12
Show InChI InChI=1S/C19H16Cl2N4O2/c1-10(26)9-27-13-4-5-15(21)14(8-13)19-24-23-18-11(2)22-16-6-3-12(20)7-17(16)25(18)19/h3-8,10,26H,9H2,1-2H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204151
PNG
(8-chloro-1-[2-chloro-5-(4,4,4-trifluoro-butoxy)-ph...)
Show SMILES Cc1nc2ccc(Cl)cc2n2c(nnc12)-c1cc(OCCCC(F)(F)F)ccc1Cl
Show InChI InChI=1S/C20H15Cl2F3N4O/c1-11-18-27-28-19(29(18)17-9-12(21)3-6-16(17)26-11)14-10-13(4-5-15(14)22)30-8-2-7-20(23,24)25/h3-6,9-10H,2,7-8H2,1H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204679
PNG
(1-(2-chloro-phenyl)-7-[2-(3,4-dimethoxy-phenyl)-et...)
Show SMILES COc1ccc(CCOc2ccc3c(c2)nc(C)c2nnc(-c4ccccc4Cl)n32)cc1OC
Show InChI InChI=1S/C26H23ClN4O3/c1-16-25-29-30-26(19-6-4-5-7-20(19)27)31(25)22-10-9-18(15-21(22)28-16)34-13-12-17-8-11-23(32-2)24(14-17)33-3/h4-11,14-15H,12-13H2,1-3H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204668
PNG
(1-(2,6-difluoro-phenyl)4-methyl-7-trifluoromethyl-...)
Show SMILES Cc1nc2cc(ccc2n2c(nnc12)-c1cccc(Cl)c1Cl)C(F)(F)F
Show InChI InChI=1S/C17H9Cl2F3N4/c1-8-15-24-25-16(10-3-2-4-11(18)14(10)19)26(15)13-6-5-9(17(20,21)22)7-12(13)23-8/h2-7H,1H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204690
PNG
(7-bromo-1-(5-butoxy-2-chloro-phenyl)-4-methyl-[1,2...)
Show SMILES Cc1nc2ccccc2n2c(nnc12)-c1cc(OC(=O)C(C)(C)C)ccc1Cl
Show InChI InChI=1S/C21H19ClN4O2/c1-12-18-24-25-19(26(18)17-8-6-5-7-16(17)23-12)14-11-13(9-10-15(14)22)28-20(27)21(2,3)4/h5-11H,1-4H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204649
PNG
(1-(5-butoxy-2-fluoro-phenyl)-8-fluoro-4-methyl-[1,...)
Show SMILES CCCCOc1ccc(F)c(c1)-c1nnc2c(C)nc3ccc(F)cc3n12
Show InChI InChI=1S/C20H18F2N4O/c1-3-4-9-27-14-6-7-16(22)15(11-14)20-25-24-19-12(2)23-17-8-5-13(21)10-18(17)26(19)20/h5-8,10-11H,3-4,9H2,1-2H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204673
PNG
(1-(2-chloro-phenyl)-7-methoxy-4-methyl-[1,2,4]tria...)
Show SMILES COc1ccc2c(c1)nc(C)c1nnc(-c3ccccc3Cl)n21
Show InChI InChI=1S/C17H13ClN4O/c1-10-16-20-21-17(12-5-3-4-6-13(12)18)22(16)15-8-7-11(23-2)9-14(15)19-10/h3-9H,1-2H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204137
PNG
(8-chloro-1-(2-fluoro-phenyl)-4-methyl-[1,2,4]triaz...)
Show SMILES Cc1nc2ccc(Cl)cc2n2c(nnc12)-c1ccccc1F
Show InChI InChI=1S/C16H10ClFN4/c1-9-15-20-21-16(11-4-2-3-5-12(11)18)22(15)14-8-10(17)6-7-13(14)19-9/h2-8H,1H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))
BDBM204681
PNG
(1-(2-chloro-phenyl)-4-methyl-8-(quinolin-2-ylmetho...)
Show SMILES Cc1nc2ccc(OCc3ccc4ccccc4n3)cc2n2c(nnc12)-c1ccccc1Cl
Show InChI InChI=1S/C26H18ClN5O/c1-16-25-30-31-26(20-7-3-4-8-21(20)27)32(25)24-14-19(12-13-23(24)28-16)33-15-18-11-10-17-6-2-5-9-22(17)29-18/h2-14H,15H2,1H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA of PDE10A1 (AB 020593, 2340 bp) was synthesized and cloned into the vector pCR4. TOPO (Entelechon GmbH, Regensburg, Germany). The gene was th...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204645
PNG
(1-(2-chloro-phenyl)-8-fluoro-4-methyl-[1,2,4]triaz...)
Show SMILES Cc1nc2ccc(F)cc2n2c(nnc12)-c1ccccc1Cl
Show InChI InChI=1S/C16H10ClFN4/c1-9-15-20-21-16(11-4-2-3-5-12(11)17)22(15)14-8-10(18)6-7-13(14)19-9/h2-8H,1H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204619
PNG
(1-(2,5-dichloro-phenyl)-4-methyl-[1,2,4]triazolo[4...)
Show SMILES Cc1nc2ccccc2n2c(nnc12)-c1cc(Cl)ccc1Cl
Show InChI InChI=1S/C16H10Cl2N4/c1-9-15-20-21-16(11-8-10(17)6-7-12(11)18)22(15)14-5-3-2-4-13(14)19-9/h2-8H,1H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204636
PNG
(1-[2-chloro-5-(4-fluoro-butoxy)-phenyl]-4-methyl-[...)
Show SMILES Cc1nc2ccccc2n2c(nnc12)-c1cc(OCCCCF)ccc1Cl
Show InChI InChI=1S/C20H18ClFN4O/c1-13-19-24-25-20(26(19)18-7-3-2-6-17(18)23-13)15-12-14(8-9-16(15)21)27-11-5-4-10-22/h2-3,6-9,12H,4-5,10-11H2,1H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204639
PNG
(1-(2-chloro-5-phenethyloxy-phenyl)-4-methyl-[1,2,4...)
Show SMILES Cc1nc2ccccc2n2c(nnc12)-c1cc(OCCc2ccccc2)ccc1Cl
Show InChI InChI=1S/C24H19ClN4O/c1-16-23-27-28-24(29(23)22-10-6-5-9-21(22)26-16)19-15-18(11-12-20(19)25)30-14-13-17-7-3-2-4-8-17/h2-12,15H,13-14H2,1H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204631
PNG
(4-methyl-3-(4-methyl-[1,2,4]triazolo[4,3-a]quinoxa...)
Show SMILES Cc1ccc(O)cc1-c1nnc2c(C)nc3ccccc3n12
Show InChI InChI=1S/C17H14N4O/c1-10-7-8-12(22)9-13(10)17-20-19-16-11(2)18-14-5-3-4-6-15(14)21(16)17/h3-9,22H,1-2H3
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Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204143
PNG
(8-chloro-4-methyl-1-o-tolyl-[1,2,4]triazolo[4,3-a]...)
Show SMILES Cc1ccccc1-c1nnc2c(C)nc3ccc(Cl)cc3n12
Show InChI InChI=1S/C17H13ClN4/c1-10-5-3-4-6-13(10)17-21-20-16-11(2)19-14-8-7-12(18)9-15(14)22(16)17/h3-9H,1-2H3
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n/an/a 12n/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204664
PNG
(1-(2-fluorophenyl)-4-methyl-8-trifluoromethyl-[1,2...)
Show SMILES Cc1nc2ccc(cc2n2c(nnc12)-c1ccccc1F)C(F)(F)F
Show InChI InChI=1S/C17H10F4N4/c1-9-15-23-24-16(11-4-2-3-5-12(11)18)25(15)14-8-10(17(19,20)21)6-7-13(14)22-9/h2-8H,1H3
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n/an/a 13n/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))
BDBM204718
PNG
(4-chloro-3-(8-chloro-4-methyl-[1,2,4]triazolo[4,3-...)
Show SMILES Cc1nc2ccc(Cl)cc2n2c(nnc12)-c1cc(O)ccc1Cl
Show InChI InChI=1S/C16H10Cl2N4O/c1-8-15-20-21-16(11-7-10(23)3-4-12(11)18)22(15)14-6-9(17)2-5-13(14)19-8/h2-7,23H,1H3
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n/an/a 13n/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA of PDE10A1 (AB 020593, 2340 bp) was synthesized and cloned into the vector pCR4. TOPO (Entelechon GmbH, Regensburg, Germany). The gene was th...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204701
PNG
(3-[4-chloro-3-(4-methyl-[1,2,4]triazolo[4,3-a]quin...)
Show SMILES Cc1nc2ccccc2n2c(nnc12)-c1cc(OCCCO)ccc1Cl
Show InChI InChI=1S/C19H17ClN4O2/c1-12-18-22-23-19(24(18)17-6-3-2-5-16(17)21-12)14-11-13(7-8-15(14)20)26-10-4-9-25/h2-3,5-8,11,25H,4,9-10H2,1H3
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n/an/a 14n/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204624
PNG
(1-(2-chloro-5-methoxy-phenyl)-4-methyl-[1,2,4]tria...)
Show SMILES COc1ccc(Cl)c(c1)-c1nnc2c(C)nc3ccccc3n12
Show InChI InChI=1S/C17H13ClN4O/c1-10-16-20-21-17(12-9-11(23-2)7-8-13(12)18)22(16)15-6-4-3-5-14(15)19-10/h3-9H,1-2H3
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n/an/a 17n/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204647
PNG
(1-(2-chloro-5-methoxy-phenyl)-8-fluoro-4-methyl-[1...)
Show SMILES COc1ccc(Cl)c(c1)-c1nnc2c(C)nc3ccc(F)cc3n12
Show InChI InChI=1S/C17H12ClFN4O/c1-9-16-21-22-17(12-8-11(24-2)4-5-13(12)18)23(16)15-7-10(19)3-6-14(15)20-9/h3-8H,1-2H3
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n/an/a 17n/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204708
PNG
((S) 1-[4-chloro-3-(4-methyl-[1,2,4]triazolo[4,3-a]...)
Show SMILES C[C@H](O)COc1ccc(Cl)c(c1)-c1nnc2c(C)nc3ccc(Cl)cc3n12
Show InChI InChI=1S/C19H16Cl2N4O2/c1-10(26)9-27-13-4-5-15(21)14(8-13)19-24-23-18-11(2)22-16-6-3-12(20)7-17(16)25(18)19/h3-8,10,26H,9H2,1-2H3/t10-/m0/s1
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n/an/a 17n/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM204152
PNG
(8-chloro-1-[2-fluoro-5-(4-fluoro-butoxy)-phenyl]-4...)
Show SMILES Cc1nc2ccc(Cl)cc2n2c(nnc12)-c1cc(OCCCCF)ccc1F
Show InChI InChI=1S/C20H17ClF2N4O/c1-12-19-25-26-20(27(19)18-10-13(21)4-7-17(18)24-12)15-11-14(5-6-16(15)23)28-9-3-2-8-22/h4-7,10-11H,2-3,8-9H2,1H3
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n/an/a 18n/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The DNA encoding PDE2A (NM002599) was cloned and the gene was inserted in the baculovirus and the enzyme-protein expressed in SF21-cells. The enzyme ...


US Patent US9540379 (2017)

More data for this
Ligand-Target Pair
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* indicates data uncertainty>20%