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Patent code US10173990

Compile Data Set for Download or QSAR
Found 17 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
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM318948
PNG
(2-Methyl-2-[[7-(4-nitrophenyl)benzo[d]isothiazol-6...)
Show SMILES CC(C)(Sc1ccc2cnsc2c1-c1ccc(cc1)[N+]([O-])=O)C(O)=O
Show InChI InChI=1S/C17H14N2O4S2/c1-17(2,16(20)21)24-13-8-5-11-9-18-25-15(11)14(13)10-3-6-12(7-4-10)19(22)23/h3-9H,1-2H3,(H,20,21)
KEGG

UniProtKB/SwissProt

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UniChem
US Patent
n/an/a 12n/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd.; J-Pharma Co., Ltd.; DeThree Res. Lab. Inc.

US Patent


Assay Description
URAT1 stably expressed HEK293 cells (HEK-URAT1) or HEK293 cells transfected with empty vector (HEK-mock) were cultured in DMEM culture medium supplem...


US Patent US10173990 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM318954
PNG
(2-[[7-(4-Cyanophenyl)benzo[d]isothiazol-6-yl]thio]...)
Show SMILES CCC(CC)(Sc1ccc2cnsc2c1-c1ccc(cc1)C#N)C(O)=O
Show InChI InChI=1S/C20H18N2O2S2/c1-3-20(4-2,19(23)24)25-16-10-9-15-12-22-26-18(15)17(16)14-7-5-13(11-21)6-8-14/h5-10,12H,3-4H2,1-2H3,(H,23,24)
KEGG

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UniChem
US Patent
n/an/a 21n/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd.; J-Pharma Co., Ltd.; DeThree Res. Lab. Inc.

US Patent


Assay Description
URAT1 stably expressed HEK293 cells (HEK-URAT1) or HEK293 cells transfected with empty vector (HEK-mock) were cultured in DMEM culture medium supplem...


US Patent US10173990 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM318946
PNG
(1-[[7-(4-Cyanophenyl)benzo[d]isothiazol-6-yl]thio]...)
Show SMILES OC(=O)C1(CCC1)Sc1ccc2cnsc2c1-c1ccc(cc1)C#N
Show InChI InChI=1S/C19H14N2O2S2/c20-10-12-2-4-13(5-3-12)16-15(7-6-14-11-21-25-17(14)16)24-19(18(22)23)8-1-9-19/h2-7,11H,1,8-9H2,(H,22,23)
KEGG

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UniChem
US Patent
n/an/a 21.5n/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd.; J-Pharma Co., Ltd.; DeThree Res. Lab. Inc.

US Patent


Assay Description
URAT1 stably expressed HEK293 cells (HEK-URAT1) or HEK293 cells transfected with empty vector (HEK-mock) were cultured in DMEM culture medium supplem...


US Patent US10173990 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM318956
PNG
((E)-3-[[1-(4-cyanophenyl)naphthalen-2-yl]thio]-2-b...)
Show SMILES C\C(Sc1ccc2ccccc2c1-c1ccc(cc1)C#N)=C/C(O)=O
Show InChI InChI=1S/C21H15NO2S/c1-14(12-20(23)24)25-19-11-10-16-4-2-3-5-18(16)21(19)17-8-6-15(13-22)7-9-17/h2-12H,1H3,(H,23,24)/b14-12+
KEGG

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US Patent
n/an/a 25n/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd.; J-Pharma Co., Ltd.; DeThree Res. Lab. Inc.

US Patent


Assay Description
URAT1 stably expressed HEK293 cells (HEK-URAT1) or HEK293 cells transfected with empty vector (HEK-mock) were cultured in DMEM culture medium supplem...


US Patent US10173990 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM318947
PNG
(1-[[7-(4-Cyanophenyl)benzo[d]isothiazol-6-yl]thio]...)
Show SMILES OC(=O)C1(CCCC1)Sc1ccc2cnsc2c1-c1ccc(cc1)C#N
Show InChI InChI=1S/C20H16N2O2S2/c21-11-13-3-5-14(6-4-13)17-16(8-7-15-12-22-26-18(15)17)25-20(19(23)24)9-1-2-10-20/h3-8,12H,1-2,9-10H2,(H,23,24)
KEGG

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UniChem
US Patent
n/an/a 26.2n/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd.; J-Pharma Co., Ltd.; DeThree Res. Lab. Inc.

US Patent


Assay Description
URAT1 stably expressed HEK293 cells (HEK-URAT1) or HEK293 cells transfected with empty vector (HEK-mock) were cultured in DMEM culture medium supplem...


US Patent US10173990 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM318949
PNG
(2-Methyl-2-[[7-[4-(trifluoromethyl)phenyl]benzo[d]...)
Show SMILES CC(C)(Sc1ccc2cnsc2c1-c1ccc(cc1)C(F)(F)F)C(O)=O
Show InChI InChI=1S/C18H14F3NO2S2/c1-17(2,16(23)24)25-13-8-5-11-9-22-26-15(11)14(13)10-3-6-12(7-4-10)18(19,20)21/h3-9H,1-2H3,(H,23,24)
KEGG

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UniChem
US Patent
n/an/a 104n/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd.; J-Pharma Co., Ltd.; DeThree Res. Lab. Inc.

US Patent


Assay Description
URAT1 stably expressed HEK293 cells (HEK-URAT1) or HEK293 cells transfected with empty vector (HEK-mock) were cultured in DMEM culture medium supplem...


US Patent US10173990 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM318950
PNG
(2-[[7-(4-Chlorophenyl)benzo[d]isothiazol-6-yl]thio...)
Show SMILES CC(C)(Sc1ccc2cnsc2c1-c1ccc(Cl)cc1)C(O)=O
Show InChI InChI=1S/C17H14ClNO2S2/c1-17(2,16(20)21)22-13-8-5-11-9-19-23-15(11)14(13)10-3-6-12(18)7-4-10/h3-9H,1-2H3,(H,20,21)
KEGG

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PC sid
UniChem
US Patent
n/an/a 106n/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd.; J-Pharma Co., Ltd.; DeThree Res. Lab. Inc.

US Patent


Assay Description
URAT1 stably expressed HEK293 cells (HEK-URAT1) or HEK293 cells transfected with empty vector (HEK-mock) were cultured in DMEM culture medium supplem...


US Patent US10173990 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM318952
PNG
(2-[[7-(4-Cyano-3-fluorophenyl)benzo[d]isothiazol-6...)
Show SMILES CC(C)(Sc1ccc2cnsc2c1-c1ccc(C#N)c(F)c1)C(O)=O
Show InChI InChI=1S/C18H13FN2O2S2/c1-18(2,17(22)23)24-14-6-5-12-9-21-25-16(12)15(14)10-3-4-11(8-20)13(19)7-10/h3-7,9H,1-2H3,(H,22,23)
KEGG

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UniChem
US Patent
n/an/a 161n/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd.; J-Pharma Co., Ltd.; DeThree Res. Lab. Inc.

US Patent


Assay Description
URAT1 stably expressed HEK293 cells (HEK-URAT1) or HEK293 cells transfected with empty vector (HEK-mock) were cultured in DMEM culture medium supplem...


US Patent US10173990 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM318944
PNG
(2-[[7-(4-Cyanophenyl)benzo[d]thiazol-6-yl]thio]-2-...)
Show SMILES CC(C)(Sc1ccc2ncsc2c1-c1ccc(cc1)C#N)C(O)=O
Show InChI InChI=1S/C18H14N2O2S2/c1-18(2,17(21)22)24-14-8-7-13-16(23-10-20-13)15(14)12-5-3-11(9-19)4-6-12/h3-8,10H,1-2H3,(H,21,22)
KEGG

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UniChem
US Patent
n/an/a 170n/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd.; J-Pharma Co., Ltd.; DeThree Res. Lab. Inc.

US Patent


Assay Description
URAT1 stably expressed HEK293 cells (HEK-URAT1) or HEK293 cells transfected with empty vector (HEK-mock) were cultured in DMEM culture medium supplem...


US Patent US10173990 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM318951
PNG
(2-[[7-(3-Cyanophenyl)benzo[d]isothiazol-6-yl]thio]...)
Show SMILES CC(C)(Sc1ccc2cnsc2c1-c1cccc(c1)C#N)C(O)=O
Show InChI InChI=1S/C18H14N2O2S2/c1-18(2,17(21)22)23-14-7-6-13-10-20-24-16(13)15(14)12-5-3-4-11(8-12)9-19/h3-8,10H,1-2H3,(H,21,22)
KEGG

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UniChem
US Patent
n/an/a 205n/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd.; J-Pharma Co., Ltd.; DeThree Res. Lab. Inc.

US Patent


Assay Description
URAT1 stably expressed HEK293 cells (HEK-URAT1) or HEK293 cells transfected with empty vector (HEK-mock) were cultured in DMEM culture medium supplem...


US Patent US10173990 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM318957
PNG
(1-[[7-(4-Cyanophenyl)benzo[d]isothazol-6-yl]thio]c...)
Show SMILES OC(=O)C1(CCCCC1)Sc1ccc2cnsc2c1-c1ccc(cc1)C#N
Show InChI InChI=1S/C21H18N2O2S2/c22-12-14-4-6-15(7-5-14)18-17(9-8-16-13-23-27-19(16)18)26-21(20(24)25)10-2-1-3-11-21/h4-9,13H,1-3,10-11H2,(H,24,25)
KEGG

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PC sid
UniChem
US Patent
n/an/a 296n/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd.; J-Pharma Co., Ltd.; DeThree Res. Lab. Inc.

US Patent


Assay Description
URAT1 stably expressed HEK293 cells (HEK-URAT1) or HEK293 cells transfected with empty vector (HEK-mock) were cultured in DMEM culture medium supplem...


US Patent US10173990 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM318955
PNG
(2-[[7-(4-Cyanophenyl)benzo[d]isothiazol-6-yl]thio]...)
Show SMILES CC(C)(C)C(Sc1ccc2cnsc2c1-c1ccc(cc1)C#N)C(O)=O
Show InChI InChI=1S/C20H18N2O2S2/c1-20(2,3)18(19(23)24)25-15-9-8-14-11-22-26-17(14)16(15)13-6-4-12(10-21)5-7-13/h4-9,11,18H,1-3H3,(H,23,24)
KEGG

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UniChem
US Patent
n/an/a 474n/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd.; J-Pharma Co., Ltd.; DeThree Res. Lab. Inc.

US Patent


Assay Description
URAT1 stably expressed HEK293 cells (HEK-URAT1) or HEK293 cells transfected with empty vector (HEK-mock) were cultured in DMEM culture medium supplem...


US Patent US10173990 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM318942
PNG
(2-[(4′-Cyano[1,1′-binaphthalene]-2-yl)...)
Show SMILES CC(C)(Sc1ccc2ccccc2c1-c1ccc(C#N)c2ccccc12)C(O)=O
Show InChI InChI=1S/C25H19NO2S/c1-25(2,24(27)28)29-22-14-12-16-7-3-4-9-19(16)23(22)21-13-11-17(15-26)18-8-5-6-10-20(18)21/h3-14H,1-2H3,(H,27,28)
KEGG

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UniChem
US Patent
n/an/a 790n/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd.; J-Pharma Co., Ltd.; DeThree Res. Lab. Inc.

US Patent


Assay Description
URAT1 stably expressed HEK293 cells (HEK-URAT1) or HEK293 cells transfected with empty vector (HEK-mock) were cultured in DMEM culture medium supplem...


US Patent US10173990 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM318945
PNG
(2-[[3-(4-Cyanophenyl)quinolin-4-yl]thio]-2-methylp...)
Show SMILES CC(C)(Sc1c(cnc2ccccc12)-c1ccc(cc1)C#N)C(O)=O
Show InChI InChI=1S/C20H16N2O2S/c1-20(2,19(23)24)25-18-15-5-3-4-6-17(15)22-12-16(18)14-9-7-13(11-21)8-10-14/h3-10,12H,1-2H3,(H,23,24)
KEGG

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UniChem
US Patent
n/an/a 1.58E+3n/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd.; J-Pharma Co., Ltd.; DeThree Res. Lab. Inc.

US Patent


Assay Description
URAT1 stably expressed HEK293 cells (HEK-URAT1) or HEK293 cells transfected with empty vector (HEK-mock) were cultured in DMEM culture medium supplem...


US Patent US10173990 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM318941
PNG
(2-[(4′-Cyano-(1,1′-binaphthalene)-2-yl...)
Show SMILES CC(C)(Oc1ccc2ccccc2c1-c1ccc(C#N)c2ccccc12)C(O)=O
Show InChI InChI=1S/C25H19NO3/c1-25(2,24(27)28)29-22-14-12-16-7-3-4-9-19(16)23(22)21-13-11-17(15-26)18-8-5-6-10-20(18)21/h3-14H,1-2H3,(H,27,28)
KEGG

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UniChem
US Patent
n/an/a 2.06E+3n/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd.; J-Pharma Co., Ltd.; DeThree Res. Lab. Inc.

US Patent


Assay Description
URAT1 stably expressed HEK293 cells (HEK-URAT1) or HEK293 cells transfected with empty vector (HEK-mock) were cultured in DMEM culture medium supplem...


US Patent US10173990 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM318953
PNG
(1-[[7-(4-Cyanophenyl)-3-methylbenzo[d]isothiazol-6...)
Show SMILES Cc1nsc2c(c(SC3(CCC3)C(O)=O)ccc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C20H16N2O2S2/c1-12-15-7-8-16(25-20(19(23)24)9-2-10-20)17(18(15)26-22-12)14-5-3-13(11-21)4-6-14/h3-8H,2,9-10H2,1H3,(H,23,24)
KEGG

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UniChem
US Patent
n/an/a 2.43E+3n/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd.; J-Pharma Co., Ltd.; DeThree Res. Lab. Inc.

US Patent


Assay Description
URAT1 stably expressed HEK293 cells (HEK-URAT1) or HEK293 cells transfected with empty vector (HEK-mock) were cultured in DMEM culture medium supplem...


US Patent US10173990 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM318943
PNG
(2-[[5-(4-Cyanophenyl)quinolin-6-yl]thio]-2-methylp...)
Show SMILES CC(C)(Sc1ccc2ncccc2c1-c1ccc(cc1)[N+]#[C-])C(O)=O
Show InChI InChI=1S/C20H16N2O2S/c1-20(2,19(23)24)25-17-11-10-16-15(5-4-12-22-16)18(17)13-6-8-14(21-3)9-7-13/h4-12H,1-2H3,(H,23,24)
KEGG

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UniChem
US Patent
n/an/a 3.44E+3n/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd.; J-Pharma Co., Ltd.; DeThree Res. Lab. Inc.

US Patent


Assay Description
URAT1 stably expressed HEK293 cells (HEK-URAT1) or HEK293 cells transfected with empty vector (HEK-mock) were cultured in DMEM culture medium supplem...


US Patent US10173990 (2019)

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