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Patent code US9926318

Compile Data Set for Download or QSAR
Found 58 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
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380489
PNG
(US9926318, 1-7)
Show SMILES OC(=O)CCCN1C(=O)C2Cc3c(CN2C1=O)n(CCCc1ccccc1)c1ccccc31
Show InChI InChI=1S/C26H27N3O4/c30-24(31)13-7-15-28-25(32)22-16-20-19-11-4-5-12-21(19)27(23(20)17-29(22)26(28)33)14-6-10-18-8-2-1-3-9-18/h1-5,8-9,11-12,22H,6-7,10,13-17H2,(H,30,31)
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380498
PNG
(US9926318, 1-16)
Show SMILES Fc1ccc(Cn2c3CN4C(Cc3c3ccccc23)C(=O)NCC4=O)cc1
Show InChI InChI=1S/C21H18FN3O2/c22-14-7-5-13(6-8-14)11-24-17-4-2-1-3-15(17)16-9-18-21(27)23-10-20(26)25(18)12-19(16)24/h1-8,18H,9-12H2,(H,23,27)
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380525
PNG
(US9926318, 1-143)
Show SMILES Fc1ccc(Cn2c3CN4[C@@H](Cc3c3ccccc23)C(=O)N(CCC(=O)NS(=O)(=O)c2ccccc2)C4=O)cc1
Show InChI InChI=1S/C29H25FN4O5S/c30-20-12-10-19(11-13-20)17-33-24-9-5-4-8-22(24)23-16-25-28(36)32(29(37)34(25)18-26(23)33)15-14-27(35)31-40(38,39)21-6-2-1-3-7-21/h1-13,25H,14-18H2,(H,31,35)/t25-/m0/s1
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380511
PNG
(US9926318, 1-84)
Show SMILES OC(=O)CCN1C(=O)[C@@H]2Cc3c(CN2C1=O)n(Cc1ccc(Cl)nc1)c1ccccc31
Show InChI InChI=1S/C22H19ClN4O4/c23-19-6-5-13(10-24-19)11-26-16-4-2-1-3-14(16)15-9-17-21(30)25(8-7-20(28)29)22(31)27(17)12-18(15)26/h1-6,10,17H,7-9,11-12H2,(H,28,29)/t17-/m0/s1
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380508
PNG
(US9926318, 1-34)
Show SMILES OC(=O)C1(CN2C(=O)[C@@H]3Cc4c(CN3C2=O)n(Cc2ccc(F)cc2)c2ccccc42)CC1
Show InChI InChI=1S/C25H22FN3O4/c26-16-7-5-15(6-8-16)12-27-19-4-2-1-3-17(19)18-11-20-22(30)29(14-25(9-10-25)23(31)32)24(33)28(20)13-21(18)27/h1-8,20H,9-14H2,(H,31,32)/t20-/m0/s1
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380486
PNG
(US9926318, 1-4 | US9926318, 1-5 | US9926318, 1-6 |...)
Show SMILES OC(=O)CCN1C(=O)C2Cc3c(CN2C1=O)n(Cc1ccc(F)cc1)c1ccccc31
Show InChI InChI=1S/C23H20FN3O4/c24-15-7-5-14(6-8-15)12-26-18-4-2-1-3-16(18)17-11-19-22(30)25(10-9-21(28)29)23(31)27(19)13-20(17)26/h1-8,19H,9-13H2,(H,28,29)
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380495
PNG
(US9926318, 1-13)
Show SMILES Fc1ccc(Cn2c3CN4C(CNC4=O)Cc3c3ccccc23)cc1
Show InChI InChI=1S/C20H18FN3O/c21-14-7-5-13(6-8-14)11-24-18-4-2-1-3-16(18)17-9-15-10-22-20(25)23(15)12-19(17)24/h1-8,15H,9-12H2,(H,22,25)
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380491
PNG
(US9926318, 1-9)
Show SMILES Fc1ccc(Cn2c3CN4[C@H](COC4=O)Cc3c3ccccc23)cc1
Show InChI InChI=1S/C20H17FN2O2/c21-14-7-5-13(6-8-14)10-23-18-4-2-1-3-16(18)17-9-15-12-25-20(24)22(15)11-19(17)23/h1-8,15H,9-12H2/t15-/m0/s1
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380514
PNG
(US9926318, 1-129)
Show SMILES CN1C(=O)C2Cc3c(CN2C1=O)n(Cc1ccc(F)cc1)c1ccccc31
Show InChI InChI=1S/C21H18FN3O2/c1-23-20(26)18-10-16-15-4-2-3-5-17(15)24(19(16)12-25(18)21(23)27)11-13-6-8-14(22)9-7-13/h2-9,18H,10-12H2,1H3
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380516
PNG
(US9926318, 1-131)
Show SMILES COc1ccc(Cn2c3CN4[C@@H](Cc3c3ccccc23)C(=O)N(CCC(O)=O)C4=O)cc1
Show InChI InChI=1S/C24H23N3O5/c1-32-16-8-6-15(7-9-16)13-26-19-5-3-2-4-17(19)18-12-20-23(30)25(11-10-22(28)29)24(31)27(20)14-21(18)26/h2-9,20H,10-14H2,1H3,(H,28,29)/t20-/m0/s1
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380524
PNG
(US9926318, 1-142)
Show SMILES CS(=O)(=O)NC(=O)CCN1C(=O)[C@@H]2Cc3c(CN2C1=O)n(Cc1ccc(F)cc1)c1ccccc31
Show InChI InChI=1S/C24H23FN4O5S/c1-35(33,34)26-22(30)10-11-27-23(31)20-12-18-17-4-2-3-5-19(17)28(21(18)14-29(20)24(27)32)13-15-6-8-16(25)9-7-15/h2-9,20H,10-14H2,1H3,(H,26,30)/t20-/m0/s1
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380497
PNG
(US9926318, 1-15 | US9926318, C109)
Show SMILES Fc1ccc(Cn2c3CN4C(Cc3c3ccccc23)C(=O)NC4=O)cc1
Show InChI InChI=1S/C20H16FN3O2/c21-13-7-5-12(6-8-13)10-23-16-4-2-1-3-14(16)15-9-17-19(25)22-20(26)24(17)11-18(15)23/h1-8,17H,9-11H2,(H,22,25,26)
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380539
PNG
(US9926318, E2)
Show SMILES Fc1ccc(Cn2c3CN4[C@@H](Cc3c3ccccc23)C(=O)NC4=S)cc1
Show InChI InChI=1S/C20H16FN3OS/c21-13-7-5-12(6-8-13)10-23-16-4-2-1-3-14(16)15-9-17-19(25)22-20(26)24(17)11-18(15)23/h1-8,17H,9-11H2,(H,22,25,26)/t17-/m0/s1
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380485
PNG
(US9926318, 1-3)
Show SMILES OC(=O)CCCN1C(=O)[C@H]2Cc3c(CN2C1=O)n(Cc1ccc(F)cc1)c1ccccc31
Show InChI InChI=1S/C24H22FN3O4/c25-16-9-7-15(8-10-16)13-27-19-5-2-1-4-17(19)18-12-20-23(31)26(11-3-6-22(29)30)24(32)28(20)14-21(18)27/h1-2,4-5,7-10,20H,3,6,11-14H2,(H,29,30)/t20-/m1/s1
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380486
PNG
(US9926318, 1-4 | US9926318, 1-5 | US9926318, 1-6 |...)
Show SMILES OC(=O)CCN1C(=O)C2Cc3c(CN2C1=O)n(Cc1ccc(F)cc1)c1ccccc31
Show InChI InChI=1S/C23H20FN3O4/c24-15-7-5-14(6-8-15)12-26-18-4-2-1-3-16(18)17-11-19-22(30)25(10-9-21(28)29)23(31)27(19)13-20(17)26/h1-8,19H,9-13H2,(H,28,29)
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380497
PNG
(US9926318, 1-15 | US9926318, C109)
Show SMILES Fc1ccc(Cn2c3CN4C(Cc3c3ccccc23)C(=O)NC4=O)cc1
Show InChI InChI=1S/C20H16FN3O2/c21-13-7-5-12(6-8-13)10-23-16-4-2-1-3-14(16)15-9-17-19(25)22-20(26)24(17)11-18(15)23/h1-8,17H,9-11H2,(H,22,25,26)
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380515
PNG
(US9926318, 1-130)
Show SMILES Fc1ccc(Cn2c3CN4[C@@H](Cc3c3ccccc23)C(=O)NC4=O)cc1
Show InChI InChI=1S/C20H16FN3O2/c21-13-7-5-12(6-8-13)10-23-16-4-2-1-3-14(16)15-9-17-19(25)22-20(26)24(17)11-18(15)23/h1-8,17H,9-11H2,(H,22,25,26)/t17-/m0/s1
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380521
PNG
(US9926318, 1-139)
Show SMILES Fc1ccc(Cn2c3CN4C(Cc3c3ccccc23)C(=O)N(CC#N)C4=O)cc1
Show InChI InChI=1S/C22H17FN4O2/c23-15-7-5-14(6-8-15)12-26-18-4-2-1-3-16(18)17-11-19-21(28)25(10-9-24)22(29)27(19)13-20(17)26/h1-8,19H,10-13H2
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380534
PNG
(US9926318, C111)
Show SMILES CC(C)(CN1C(=O)C2Cc3c(CN2C1=O)n(Cc1ccc(F)cc1)c1ccccc31)C(O)=O
Show InChI InChI=1S/C25H24FN3O4/c1-25(2,23(31)32)14-29-22(30)20-11-18-17-5-3-4-6-19(17)27(21(18)13-28(20)24(29)33)12-15-7-9-16(26)10-8-15/h3-10,20H,11-14H2,1-2H3,(H,31,32)
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380483
PNG
(US9926318, 1-1)
Show SMILES OC(=O)CCCN1C(=O)C2Cc3c(CN2C1=O)n(Cc1ccc(F)cc1)c1ccccc31
Show InChI InChI=1S/C24H22FN3O4/c25-16-9-7-15(8-10-16)13-27-19-5-2-1-4-17(19)18-12-20-23(31)26(11-3-6-22(29)30)24(32)28(20)14-21(18)27/h1-2,4-5,7-10,20H,3,6,11-14H2,(H,29,30)
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380496
PNG
(US9926318, 1-14)
Show SMILES CN1CC2Cc3c(CN2C1=O)n(Cc1ccc(F)cc1)c1ccccc31
Show InChI InChI=1S/C21H20FN3O/c1-23-12-16-10-18-17-4-2-3-5-19(17)25(20(18)13-24(16)21(23)26)11-14-6-8-15(22)9-7-14/h2-9,16H,10-13H2,1H3
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380499
PNG
(US9926318, 1-18)
Show SMILES COc1ccc(Cn2c3CN4[C@@H](Cc3c3ccccc23)C(=O)N(CC2(CC2)C(O)=O)C4=O)cn1
Show InChI InChI=1S/C25H24N4O5/c1-34-21-7-6-15(11-26-21)12-27-18-5-3-2-4-16(18)17-10-19-22(30)29(14-25(8-9-25)23(31)32)24(33)28(19)13-20(17)27/h2-7,11,19H,8-10,12-14H2,1H3,(H,31,32)/t19-/m0/s1
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380504
PNG
(US9926318, 1-24)
Show SMILES OC(=O)CCN1CC(=O)N2Cc3c(CC2C1=O)c1ccccc1n3Cc1ccc(F)cc1
Show InChI InChI=1S/C24H22FN3O4/c25-16-7-5-15(6-8-16)12-27-19-4-2-1-3-17(19)18-11-20-24(32)26(10-9-23(30)31)14-22(29)28(20)13-21(18)27/h1-8,20H,9-14H2,(H,30,31)
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380502
PNG
(US9926318, 1-21)
Show SMILES OC(=O)CCN1CC2Cc3c(CN2C1=O)n(Cc1ccc(F)cc1)c1ccccc31
Show InChI InChI=1S/C23H22FN3O3/c24-16-7-5-15(6-8-16)12-27-20-4-2-1-3-18(20)19-11-17-13-25(10-9-22(28)29)23(30)26(17)14-21(19)27/h1-8,17H,9-14H2,(H,28,29)
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380526
PNG
(US9926318, A11 | US9926318, C11)
Show SMILES CC1(C)C2N(Cc3c1c1ccccc1n3Cc1ccc(F)cc1)C(=O)N(CCC(O)=O)C2=O
Show InChI InChI=1S/C25H24FN3O4/c1-25(2)21-17-5-3-4-6-18(17)28(13-15-7-9-16(26)10-8-15)19(21)14-29-22(25)23(32)27(24(29)33)12-11-20(30)31/h3-10,22H,11-14H2,1-2H3,(H,30,31)
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380540
PNG
(US9926318, E3)
Show SMILES Fc1ccc(Cn2c3CN4C(Cc3c3cccnc23)C(=O)NC4=S)cc1
Show InChI InChI=1S/C19H15FN4OS/c20-12-5-3-11(4-6-12)9-23-16-10-24-15(18(25)22-19(24)26)8-14(16)13-2-1-7-21-17(13)23/h1-7,15H,8-10H2,(H,22,25,26)
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380500
PNG
(US9926318, 1-19)
Show SMILES OC(=O)CN1C(=O)C2Cc3c(CN2C1=O)n(Cc1ccc(F)cc1)c1ccccc31
Show InChI InChI=1S/C22H18FN3O4/c23-14-7-5-13(6-8-14)10-24-17-4-2-1-3-15(17)16-9-18-21(29)26(12-20(27)28)22(30)25(18)11-19(16)24/h1-8,18H,9-12H2,(H,27,28)
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380509
PNG
(US9926318, 1-39)
Show SMILES CC(C)(CCN1C(=O)[C@@H]2Cc3c(CN2C1=O)n(Cc1ccc(F)cc1)c1ccccc31)C(O)=O
Show InChI InChI=1S/C26H26FN3O4/c1-26(2,24(32)33)11-12-28-23(31)21-13-19-18-5-3-4-6-20(18)29(22(19)15-30(21)25(28)34)14-16-7-9-17(27)10-8-16/h3-10,21H,11-15H2,1-2H3,(H,32,33)/t21-/m0/s1
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380513
PNG
(US9926318, 1-121)
Show SMILES OCCN1C(=O)C2Cc3c(CN2C1=O)n(Cc1ccc(F)cc1)c1ccccc31
Show InChI InChI=1S/C22H20FN3O3/c23-15-7-5-14(6-8-15)12-25-18-4-2-1-3-16(18)17-11-19-21(28)24(9-10-27)22(29)26(19)13-20(17)25/h1-8,19,27H,9-13H2
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380520
PNG
(US9926318, 1-135)
Show SMILES OC(=O)CCN1C(=O)[C@@H]2Cc3c(CN2C1=O)n(Cc1ccc(F)nc1)c1ccccc31
Show InChI InChI=1S/C22H19FN4O4/c23-19-6-5-13(10-24-19)11-26-16-4-2-1-3-14(16)15-9-17-21(30)25(8-7-20(28)29)22(31)27(17)12-18(15)26/h1-6,10,17H,7-9,11-12H2,(H,28,29)/t17-/m0/s1
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380522
PNG
(US9926318, 1-140)
Show SMILES Fc1ccc(Cn2c3CN4C(Cc3c3ccccc23)C(=O)N(Cc2nn[nH]n2)C4=O)cc1
Show InChI InChI=1/C22H18FN7O2/c23-14-7-5-13(6-8-14)10-28-17-4-2-1-3-15(17)16-9-18-21(31)30(12-20-24-26-27-25-20)22(32)29(18)11-19(16)28/h1-8,18H,9-12H2,(H,24,25,26,27)
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380536
PNG
(US9926318, C114 entA)
Show SMILES OC(=O)CCN1C(=O)[C@H]2Cc3c(CN2C1=O)n(Cc1ccc(F)cc1)c1ccccc31
Show InChI InChI=1S/C23H20FN3O4/c24-15-7-5-14(6-8-15)12-26-18-4-2-1-3-16(18)17-11-19-22(30)25(10-9-21(28)29)23(31)27(19)13-20(17)26/h1-8,19H,9-13H2,(H,28,29)/t19-/m1/s1
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380493
PNG
(US9926318, 1-11)
Show SMILES COc1ccc(Cn2c3CN4[C@@H](Cc3c3ccccc23)C(=O)N(CCCC(O)=O)C4=O)cn1
Show InChI InChI=1S/C24H24N4O5/c1-33-21-9-8-15(12-25-21)13-27-18-6-3-2-5-16(18)17-11-19-23(31)26(10-4-7-22(29)30)24(32)28(19)14-20(17)27/h2-3,5-6,8-9,12,19H,4,7,10-11,13-14H2,1H3,(H,29,30)/t19-/m0/s1
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380503
PNG
(US9926318, 1-23)
Show SMILES OC(=O)CN1CC(=O)N2Cc3c(CC2C1=O)c1ccccc1n3Cc1ccc(F)cc1
Show InChI InChI=1S/C23H20FN3O4/c24-15-7-5-14(6-8-15)10-26-18-4-2-1-3-16(18)17-9-19-23(31)25(13-22(29)30)12-21(28)27(19)11-20(17)26/h1-8,19H,9-13H2,(H,29,30)
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380512
PNG
(US9926318, 1-102)
Show SMILES OC(=O)CCN1C(=O)[C@@H]2Cc3c(CN2C1=O)n(Cc1cnc(s1)C(F)(F)F)c1ccccc31
Show InChI InChI=1S/C21H17F3N4O4S/c22-21(23,24)19-25-8-11(33-19)9-27-14-4-2-1-3-12(14)13-7-15-18(31)26(6-5-17(29)30)20(32)28(15)10-16(13)27/h1-4,8,15H,5-7,9-10H2,(H,29,30)/t15-/m0/s1
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380519
PNG
(US9926318, 1-134)
Show SMILES OC(=O)CCN1C(=O)[C@@H]2Cc3c(CN2C1=O)n(Cc1ccc(F)cc1F)c1ccccc31
Show InChI InChI=1S/C23H19F2N3O4/c24-14-6-5-13(17(25)9-14)11-27-18-4-2-1-3-15(18)16-10-19-22(31)26(8-7-21(29)30)23(32)28(19)12-20(16)27/h1-6,9,19H,7-8,10-12H2,(H,29,30)/t19-/m0/s1
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380527
PNG
(US9926318, A110)
Show SMILES CC1(C)C2N(Cc3c1c1ccccc1n3Cc1ccc(F)cc1)C(=O)NC2=O
Show InChI InChI=1S/C22H20FN3O2/c1-22(2)18-15-5-3-4-6-16(15)25(11-13-7-9-14(23)10-8-13)17(18)12-26-19(22)20(27)24-21(26)28/h3-10,19H,11-12H2,1-2H3,(H,24,27,28)
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380528
PNG
(US9926318, A110 ent A)
Show SMILES CC1(C)[C@H]2N(Cc3c1c1ccccc1n3Cc1ccc(F)cc1)C(=O)NC2=O
Show InChI InChI=1S/C22H20FN3O2/c1-22(2)18-15-5-3-4-6-16(15)25(11-13-7-9-14(23)10-8-13)17(18)12-26-19(22)20(27)24-21(26)28/h3-10,19H,11-12H2,1-2H3,(H,24,27,28)/t19-/m0/s1
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380526
PNG
(US9926318, A11 | US9926318, C11)
Show SMILES CC1(C)C2N(Cc3c1c1ccccc1n3Cc1ccc(F)cc1)C(=O)N(CCC(O)=O)C2=O
Show InChI InChI=1S/C25H24FN3O4/c1-25(2)21-17-5-3-4-6-18(17)28(13-15-7-9-16(26)10-8-15)19(21)14-29-22(25)23(32)27(24(29)33)12-11-20(30)31/h3-10,22H,11-14H2,1-2H3,(H,30,31)
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380484
PNG
(US9926318, 1-2)
Show SMILES OC(=O)CCCN1C(=O)[C@@H]2Cc3c(CN2C1=O)n(Cc1ccc(F)cc1)c1ccccc31
Show InChI InChI=1S/C24H22FN3O4/c25-16-9-7-15(8-10-16)13-27-19-5-2-1-4-17(19)18-12-20-23(31)26(11-3-6-22(29)30)24(32)28(20)14-21(18)27/h1-2,4-5,7-10,20H,3,6,11-14H2,(H,29,30)/t20-/m0/s1
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380486
PNG
(US9926318, 1-4 | US9926318, 1-5 | US9926318, 1-6 |...)
Show SMILES OC(=O)CCN1C(=O)C2Cc3c(CN2C1=O)n(Cc1ccc(F)cc1)c1ccccc31
Show InChI InChI=1S/C23H20FN3O4/c24-15-7-5-14(6-8-15)12-26-18-4-2-1-3-16(18)17-11-19-22(30)25(10-9-21(28)29)23(31)27(19)13-20(17)26/h1-8,19H,9-13H2,(H,28,29)
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380494
PNG
(US9926318, 1-12)
Show SMILES COc1ccc(Cn2c3CN4[C@@H](Cc3c3ccccc23)C(=O)N(CCC(O)=O)C4=O)cn1
Show InChI InChI=1S/C23H22N4O5/c1-32-20-7-6-14(11-24-20)12-26-17-5-3-2-4-15(17)16-10-18-22(30)25(9-8-21(28)29)23(31)27(18)13-19(16)26/h2-7,11,18H,8-10,12-13H2,1H3,(H,28,29)/t18-/m0/s1
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380507
PNG
(US9926318, 1-30)
Show SMILES CC(C)(CN1C(=O)[C@@H]2Cc3c(CN2C1=O)n(Cc1ccc(F)cc1)c1ccccc31)C(O)=O
Show InChI InChI=1S/C25H24FN3O4/c1-25(2,23(31)32)14-29-22(30)20-11-18-17-5-3-4-6-19(17)27(21(18)13-28(20)24(29)33)12-15-7-9-16(26)10-8-15/h3-10,20H,11-14H2,1-2H3,(H,31,32)/t20-/m0/s1
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380510
PNG
(US9926318, 1-42)
Show SMILES CC(C)(CN1C(=O)[C@@H]2Cc3c(CN2C1=O)n(Cc1ccc(F)cc1)c1ccccc31)CC(O)=O
Show InChI InChI=1S/C26H26FN3O4/c1-26(2,12-23(31)32)15-30-24(33)21-11-19-18-5-3-4-6-20(18)28(22(19)14-29(21)25(30)34)13-16-7-9-17(27)10-8-16/h3-10,21H,11-15H2,1-2H3,(H,31,32)/t21-/m0/s1
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380517
PNG
(US9926318, 1-132)
Show SMILES OC(=O)CCN1C(=O)[C@@H]2Cc3c(CN2C1=O)n(Cc1ccc(Cl)cc1Cl)c1ccccc31
Show InChI InChI=1S/C23H19Cl2N3O4/c24-14-6-5-13(17(25)9-14)11-27-18-4-2-1-3-15(18)16-10-19-22(31)26(8-7-21(29)30)23(32)28(19)12-20(16)27/h1-6,9,19H,7-8,10-12H2,(H,29,30)/t19-/m0/s1
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380518
PNG
(US9926318, 1-133)
Show SMILES OC(=O)CCN1C(=O)[C@@H]2Cc3c(CN2C1=O)n(Cc1ccc(Cl)cc1F)c1ccccc31
Show InChI InChI=1S/C23H19ClFN3O4/c24-14-6-5-13(17(25)9-14)11-27-18-4-2-1-3-15(18)16-10-19-22(31)26(8-7-21(29)30)23(32)28(19)12-20(16)27/h1-6,9,19H,7-8,10-12H2,(H,29,30)/t19-/m0/s1
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380529
PNG
(US9926318, A110 ent B)
Show SMILES CC1(C)[C@@H]2N(Cc3c1c1ccccc1n3Cc1ccc(F)cc1)C(=O)NC2=O
Show InChI InChI=1S/C22H20FN3O2/c1-22(2)18-15-5-3-4-6-16(15)25(11-13-7-9-14(23)10-8-13)17(18)12-26-19(22)20(27)24-21(26)28/h3-10,19H,11-12H2,1-2H3,(H,24,27,28)/t19-/m1/s1
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380532
PNG
(US9926318, C13)
Show SMILES CC(C)(CN1C(=O)C2N(Cc3c(c4ccccc4n3Cc3ccc(F)cc3)C2(C)C)C1=O)C(O)=O
Show InChI InChI=1S/C27H28FN3O4/c1-26(2,24(33)34)15-31-23(32)22-27(3,4)21-18-7-5-6-8-19(18)29(20(21)14-30(22)25(31)35)13-16-9-11-17(28)12-10-16/h5-12,22H,13-15H2,1-4H3,(H,33,34)
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380537
PNG
(US9926318, C114 entB)
Show SMILES OC(=O)CCN1C(=O)[C@@H]2Cc3c(CN2C1=O)n(Cc1ccc(F)cc1)c1ccccc31
Show InChI InChI=1S/C23H20FN3O4/c24-15-7-5-14(6-8-15)12-26-18-4-2-1-3-16(18)17-11-19-22(30)25(10-9-21(28)29)23(31)27(19)13-20(17)26/h1-8,19H,9-13H2,(H,28,29)/t19-/m0/s1
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n/an/a<500n/an/an/an/an/an/a



PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380486
PNG
(US9926318, 1-4 | US9926318, 1-5 | US9926318, 1-6 |...)
Show SMILES OC(=O)CCN1C(=O)C2Cc3c(CN2C1=O)n(Cc1ccc(F)cc1)c1ccccc31
Show InChI InChI=1S/C23H20FN3O4/c24-15-7-5-14(6-8-15)12-26-18-4-2-1-3-16(18)17-11-19-22(30)25(10-9-21(28)29)23(31)27(19)13-20(17)26/h1-8,19H,9-13H2,(H,28,29)
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380490
PNG
(US9926318, 1-8)
Show SMILES Fc1ccc(Cn2c3CN4C(COC4=O)Cc3c3ccccc23)cc1
Show InChI InChI=1S/C20H17FN2O2/c21-14-7-5-13(6-8-14)10-23-18-4-2-1-3-16(18)17-9-15-12-25-20(24)22(15)11-19(17)23/h1-8,15H,9-12H2
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380501
PNG
(US9926318, 1-20)
Show SMILES OC(=O)CN1CC2Cc3c(CN2C1=O)n(Cc1ccc(F)cc1)c1ccccc31
Show InChI InChI=1S/C22H20FN3O3/c23-15-7-5-14(6-8-15)10-26-19-4-2-1-3-17(19)18-9-16-11-24(13-21(27)28)22(29)25(16)12-20(18)26/h1-8,16H,9-13H2,(H,27,28)
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380505
PNG
(US9926318, 1-26)
Show SMILES Fc1ccc(Cn2c3CN4[C@@H](Cc3c3ccc(Cl)cc23)C(=O)NC4=O)cc1
Show InChI InChI=1S/C20H15ClFN3O2/c21-12-3-6-14-15-8-17-19(26)23-20(27)25(17)10-18(15)24(16(14)7-12)9-11-1-4-13(22)5-2-11/h1-7,17H,8-10H2,(H,23,26,27)/t17-/m0/s1
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380538
PNG
(US9926318, E1)
Show SMILES OC(=O)CCN1C(=O)[C@@H]2Cc3c(CN2C1=S)n(Cc1ccc(F)cc1)c1ccccc31
Show InChI InChI=1S/C23H20FN3O3S/c24-15-7-5-14(6-8-15)12-26-18-4-2-1-3-16(18)17-11-19-22(30)25(10-9-21(28)29)23(31)27(19)13-20(17)26/h1-8,19H,9-13H2,(H,28,29)/t19-/m0/s1
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380523
PNG
(US9926318, 1-141)
Show SMILES OC(=O)CCN1C(=O)N2Cc3c(C[C@H]2C1=S)c1ccccc1n3Cc1ccc(F)cc1
Show InChI InChI=1S/C23H20FN3O3S/c24-15-7-5-14(6-8-15)12-26-18-4-2-1-3-16(18)17-11-19-22(31)25(10-9-21(28)29)23(30)27(19)13-20(17)26/h1-8,19H,9-13H2,(H,28,29)/t19-/m0/s1
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380492
PNG
(US9926318, 1-10)
Show SMILES Fc1ccc(Cn2c3CN4[C@@H](COC4=O)Cc3c3ccccc23)cc1
Show InChI InChI=1S/C20H17FN2O2/c21-14-7-5-13(6-8-14)10-23-18-4-2-1-3-16(18)17-9-15-12-25-20(24)22(15)11-19(17)23/h1-8,15H,9-12H2/t15-/m1/s1
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380506
PNG
(US9926318, 1-27)
Show SMILES OC(=O)CCCN1C(=O)[C@@H]2Cc3c(CN2C1=O)n(Cc1ccc(F)cc1)c1cc(Cl)ccc31
Show InChI InChI=1S/C24H21ClFN3O4/c25-15-5-8-17-18-11-20-23(32)27(9-1-2-22(30)31)24(33)29(20)13-21(18)28(19(17)10-15)12-14-3-6-16(26)7-4-14/h3-8,10,20H,1-2,9,11-13H2,(H,30,31)/t20-/m0/s1
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM380530
PNG
(US9926318, A113)
Show SMILES CC12Cc3c(CN1C(=O)N(CCC(O)=O)C2=O)n(Cc1ccc(F)cc1)c1ccccc31
Show InChI InChI=1S/C24H22FN3O4/c1-24-12-18-17-4-2-3-5-19(17)27(13-15-6-8-16(25)9-7-15)20(18)14-28(24)23(32)26(22(24)31)11-10-21(29)30/h2-9H,10-14H2,1H3,(H,29,30)
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PHARMAKEA, INC.

US Patent


Assay Description
ATX activity is assayed in concentrated conditioned media from Hep3B human hepatocellular carcinoma cells by measuring the amount of choline released...


US Patent US9926318 (2018)

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