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Patent code US9422318

Compile Data Set for Download or QSAR
Found 37 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
Epoxide hydratase


(Homo sapiens (Human))
BDBM50057466
PNG
(CHEMBL3322807 | US9127027, 13 | US9422318, 13)
Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCSc1ccccc1O
Show InChI InChI=1S/C23H38N2O2S/c1-2-3-13-18-24-23(27)25-19-14-9-7-5-4-6-8-10-15-20-28-22-17-12-11-16-21(22)26/h4-5,11-12,16-17,26H,2-3,6-10,13-15,18-20H2,1H3,(H2,24,25,27)/b5-4-
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n/an/a 6n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50057625
PNG
(CHEMBL3322818 | US9127027, 25 | US9422318, 25)
Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCCC1=NOS(=O)N1
Show InChI InChI=1S/C19H36N4O3S/c1-2-3-13-16-20-19(24)21-17-14-11-9-7-5-4-6-8-10-12-15-18-22-26-27(25)23-18/h5,7H,2-4,6,8-17H2,1H3,(H,22,23)(H2,20,21,24)/b7-5-
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n/an/a 10n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50057494
PNG
(CHEMBL3322814 | US9127027, 20 | US9127027, LGK-I-1...)
Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCCc1nnn[nH]1
Show InChI InChI=1S/C19H36N6O/c1-2-3-13-16-20-19(26)21-17-14-11-9-7-5-4-6-8-10-12-15-18-22-24-25-23-18/h5,7H,2-4,6,8-17H2,1H3,(H2,20,21,26)(H,22,23,24,25)/b7-5-
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n/an/a 11n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50057494
PNG
(CHEMBL3322814 | US9127027, 20 | US9127027, LGK-I-1...)
Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCCc1nnn[nH]1
Show InChI InChI=1S/C19H36N6O/c1-2-3-13-16-20-19(26)21-17-14-11-9-7-5-4-6-8-10-12-15-18-22-24-25-23-18/h5,7H,2-4,6,8-17H2,1H3,(H2,20,21,26)(H,22,23,24,25)/b7-5-
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n/an/a 11n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50057474
PNG
(CHEMBL3322808 | US9127027, 14 | US9422318, 14)
Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCS(=O)(=O)c1ccccc1O
Show InChI InChI=1S/C23H38N2O4S/c1-2-3-13-18-24-23(27)25-19-14-9-7-5-4-6-8-10-15-20-30(28,29)22-17-12-11-16-21(22)26/h4-5,11-12,16-17,26H,2-3,6-10,13-15,18-20H2,1H3,(H2,24,25,27)/b5-4-
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n/an/a 11n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50057480
PNG
(CHEMBL3322809 | US9127027, 15 | US9422318, 15)
Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCSc1nnn[nH]1
Show InChI InChI=1S/C18H34N6OS/c1-2-3-11-14-19-17(25)20-15-12-9-7-5-4-6-8-10-13-16-26-18-21-23-24-22-18/h4-5H,2-3,6-16H2,1H3,(H2,19,20,25)(H,21,22,23,24)/b5-4-
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n/an/a 22n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50057491
PNG
(CHEMBL3322812 | US9127027, 18 | US9422318, 18)
Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCS(=O)(=O)c1ncn[nH]1
Show InChI InChI=1S/C19H35N5O3S/c1-2-3-11-14-20-18(25)21-15-12-9-7-5-4-6-8-10-13-16-28(26,27)19-22-17-23-24-19/h4-5,17H,2-3,6-16H2,1H3,(H2,20,21,25)(H,22,23,24)/b5-4-
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n/an/a 23n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50057633
PNG
(CHEMBL3322821 | US9127027, 28 | US9422318, 28)
Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCCc1noc(=S)[nH]1
Show InChI InChI=1S/C20H36N4O2S/c1-2-3-13-16-21-19(25)22-17-14-11-9-7-5-4-6-8-10-12-15-18-23-20(27)26-24-18/h5,7H,2-4,6,8-17H2,1H3,(H2,21,22,25)(H,23,24,27)/b7-5-
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n/an/a 31n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50057497
PNG
(CHEMBL3322815 | US9127027, 22 | US9422318, 22)
Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCCCc1nnn[nH]1
Show InChI InChI=1S/C20H38N6O/c1-2-3-14-17-21-20(27)22-18-15-12-10-8-6-4-5-7-9-11-13-16-19-23-25-26-24-19/h6,8H,2-5,7,9-18H2,1H3,(H2,21,22,27)(H,23,24,25,26)/b8-6-
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n/an/a 32n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50057450
PNG
(CHEMBL3322804 | US9127027, 12 | US9422318, 12)
Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCNS(=O)(=O)c1ccccc1
Show InChI InChI=1S/C23H39N3O3S/c1-2-3-14-19-24-23(27)25-20-15-9-7-5-4-6-8-10-16-21-26-30(28,29)22-17-12-11-13-18-22/h4-5,11-13,17-18,26H,2-3,6-10,14-16,19-21H2,1H3,(H2,24,25,27)/b5-4-
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n/an/a 32n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50057481
PNG
(CHEMBL3322810 | US9127027, 16 | US9422318, 16)
Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCSc1ncn[nH]1
Show InChI InChI=1S/C19H35N5OS/c1-2-3-11-14-20-18(25)21-15-12-9-7-5-4-6-8-10-13-16-26-19-22-17-23-24-19/h4-5,17H,2-3,6-16H2,1H3,(H2,20,21,25)(H,22,23,24)/b5-4-
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n/an/a 32n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50057445
PNG
(CHEMBL3322802 | US9127027, 8 | US9422318, 8)
Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCCC(=O)NS(=O)(=O)c1ccccc1
Show InChI InChI=1S/C25H41N3O4S/c1-2-3-16-21-26-25(30)27-22-17-11-9-7-5-4-6-8-10-15-20-24(29)28-33(31,32)23-18-13-12-14-19-23/h5,7,12-14,18-19H,2-4,6,8-11,15-17,20-22H2,1H3,(H,28,29)(H2,26,27,30)/b7-5-
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n/an/a 41n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM62387
PNG
(US9127027, 11)
Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCCS([O-])(=O)=O
Show InChI InChI=1S/C18H36N2O4S/c1-2-3-12-15-19-18(21)20-16-13-10-8-6-4-5-7-9-11-14-17-25(22,23)24/h4,6H,2-3,5,7-17H2,1H3,(H2,19,20,21)(H,22,23,24)/p-1/b6-4-
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n/an/a 57n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50057635
PNG
(CHEMBL3322823 | US9127027, 24 | US9422318, 24)
Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCC1SC(=O)NC1=O
Show InChI InChI=1S/C20H35N3O3S/c1-2-3-12-15-21-19(25)22-16-13-10-8-6-4-5-7-9-11-14-17-18(24)23-20(26)27-17/h4,6,17H,2-3,5,7-16H2,1H3,(H2,21,22,25)(H,23,24,26)/b6-4-
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n/an/a 57n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50057506
PNG
(CHEMBL3322817 | US9127027, 23 | US9422318, 23)
Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCCc1noc(=O)[nH]1
Show InChI InChI=1S/C20H36N4O3/c1-2-3-13-16-21-19(25)22-17-14-11-9-7-5-4-6-8-10-12-15-18-23-20(26)27-24-18/h5,7H,2-4,6,8-17H2,1H3,(H2,21,22,25)(H,23,24,26)/b7-5-
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n/an/a 65n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50057446
PNG
(CHEMBL3322803 | US9127027, 9 | US9422318, 9)
Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCCC(=O)NS(C)(=O)=O
Show InChI InChI=1S/C20H39N3O4S/c1-3-4-14-17-21-20(25)22-18-15-12-10-8-6-5-7-9-11-13-16-19(24)23-28(2,26)27/h6,8H,3-5,7,9-18H2,1-2H3,(H,23,24)(H2,21,22,25)/b8-6-
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n/an/a 71n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM179758
PNG
(US9127027, 17 | US9422318, 17)
Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCS(=O)c1ncn[nH]1
Show InChI InChI=1S/C19H35N5O2S/c1-2-3-11-14-20-18(25)21-15-12-9-7-5-4-6-8-10-13-16-27(26)19-22-17-23-24-19/h4-5,17H,2-3,6-16H2,1H3,(H2,20,21,25)(H,22,23,24)/b5-4-
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n/an/a 96n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50057634
PNG
(CHEMBL3322822 | US9127027, 29 | US9422318, 29)
Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCCc1nsc(=O)[nH]1
Show InChI InChI=1S/C20H36N4O2S/c1-2-3-13-16-21-19(25)22-17-14-11-9-7-5-4-6-8-10-12-15-18-23-20(26)27-24-18/h5,7H,2-4,6,8-17H2,1H3,(H2,21,22,25)(H,23,24,26)/b7-5-
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n/an/a 231n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM179753
PNG
(US9127027, 4 | US9422318, 4)
Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCOCC(O)=O
Show InChI InChI=1S/C18H34N2O4/c1-2-3-10-13-19-18(23)20-14-11-8-6-4-5-7-9-12-15-24-16-17(21)22/h4-5H,2-3,6-16H2,1H3,(H,21,22)(H2,19,20,23)/b5-4-
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n/an/a 237n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50057420
PNG
(CHEMBL3322797 | US9127027, 2 | US9422318, 2)
Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCCC(=O)OCCOCCOCCO
Show InChI InChI=1S/C25H48N2O6/c1-2-3-13-16-26-25(30)27-17-14-11-9-7-5-4-6-8-10-12-15-24(29)33-23-22-32-21-20-31-19-18-28/h5,7,28H,2-4,6,8-23H2,1H3,(H2,26,27,30)/b7-5-
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n/an/a 255n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM242781
PNG
(US9422318, 33)
Show SMILES CCCCCNC(=O)NCCCCCCCCOc1cccc2sc(NC(C)=O)nc12
Show InChI InChI=1S/C22H33N4O4S/c1-3-4-6-12-23-21(28)24-13-7-5-8-14-29-15-16-30-18-10-9-11-19-20(18)26-22(31-19)25-17(2)27/h9-11,14H,3-8,12-13,15-16H2,1-2H3,(H2,23,24,28)(H,25,26,27)
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n/an/a 282n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM64550
PNG
(US9127027, JLJ-I-94-6)
Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCCC(=O)N[C@H](CC([O-])=O)C([O-])=O
Show InChI InChI=1S/C23H41N3O6/c1-2-3-13-16-24-23(32)25-17-14-11-9-7-5-4-6-8-10-12-15-20(27)26-19(22(30)31)18-21(28)29/h5,7,19H,2-4,6,8-18H2,1H3,(H,26,27)(H,28,29)(H,30,31)(H2,24,25,32)/p-2/b7-5-/t19-/m1/s1
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n/an/a 392n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM179755
PNG
(US9127027, 7 | US9422318, 7)
Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCCC(=O)N[C@@H](CC(O)=O)C(O)=O
Show InChI InChI=1S/C23H41N3O6/c1-2-3-13-16-24-23(32)25-17-14-11-9-7-5-4-6-8-10-12-15-20(27)26-19(22(30)31)18-21(28)29/h5,7,19H,2-4,6,8-18H2,1H3,(H,26,27)(H,28,29)(H,30,31)(H2,24,25,32)/b7-5-/t19-/m0/s1
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n/an/a 392n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50057638
PNG
(CHEMBL3322826 | US9127027, 31 | US9422318, 31)
Show SMILES CCCCCNC(=O)NCCCCCOc1cccc2sc(NC(C)=O)nc12
Show InChI InChI=1S/C20H30N4O3S/c1-3-4-6-12-21-19(26)22-13-7-5-8-14-27-16-10-9-11-17-18(16)24-20(28-17)23-15(2)25/h9-11H,3-8,12-14H2,1-2H3,(H2,21,22,26)(H,23,24,25)
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n/an/a>500n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50057419
PNG
(CHEMBL3322796 | US9422318, 1)
Show SMILES CCCCCCC(=O)N(CCCC\C=C/CCCCCCC(=O)OCCOCCOCCO)C(C)C
Show InChI InChI=1S/C29H55NO6/c1-4-5-6-15-18-28(32)30(27(2)3)20-17-14-12-10-8-7-9-11-13-16-19-29(33)36-26-25-35-24-23-34-22-21-31/h8,10,27,31H,4-7,9,11-26H2,1-3H3/b10-8-
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n/an/a>500n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50057630
PNG
(CHEMBL3322819 | US9127027, SRD-I-71-9 | US9422318,...)
Show SMILES CCCCCCC(=O)N(CCCC\C=C/CCCCCCC1=NOS(=O)N1)C(C)C
Show InChI InChI=1S/C23H43N3O3S/c1-4-5-6-16-19-23(27)26(21(2)3)20-17-14-12-10-8-7-9-11-13-15-18-22-24-29-30(28)25-22/h8,10,21H,4-7,9,11-20H2,1-3H3,(H,24,25)/b10-8-
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n/an/a>500n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50057493
PNG
(CHEMBL3322813 | US9422318, 19)
Show SMILES CCCCCCC(=O)N(CCCC\C=C/CCCCCCc1nnn[nH]1)C(C)C
Show InChI InChI=1S/C23H43N5O/c1-4-5-6-16-19-23(29)28(21(2)3)20-17-14-12-10-8-7-9-11-13-15-18-22-24-26-27-25-22/h8,10,21H,4-7,9,11-20H2,1-3H3,(H,24,25,26,27)/b10-8-
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n/an/a>500n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50057639
PNG
(CHEMBL3322827 | US9127027, 32 | US9422318, 32)
Show SMILES CCCCNC(=O)C(=O)NCCCCCOc1cccc2sc(NC(C)=O)nc12
Show InChI InChI=1S/C20H28N4O4S/c1-3-4-11-21-18(26)19(27)22-12-6-5-7-13-28-15-9-8-10-16-17(15)24-20(29-16)23-14(2)25/h8-10H,3-7,11-13H2,1-2H3,(H,21,26)(H,22,27)(H,23,24,25)
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n/an/a>500n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50057423
PNG
(CHEMBL3322800 | US9127027, 6 | US9422318, 6)
Show SMILES CCCCCN(C)C(=O)N(C)CCCC\C=C/CCCCCCC(=O)NCC(O)=O
Show InChI InChI=1S/C23H43N3O4/c1-4-5-15-18-25(2)23(30)26(3)19-16-13-11-9-7-6-8-10-12-14-17-21(27)24-20-22(28)29/h7,9H,4-6,8,10-20H2,1-3H3,(H,24,27)(H,28,29)/b9-7-
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n/an/a>500n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50057630
PNG
(CHEMBL3322819 | US9127027, SRD-I-71-9 | US9422318,...)
Show SMILES CCCCCCC(=O)N(CCCC\C=C/CCCCCCC1=NOS(=O)N1)C(C)C
Show InChI InChI=1S/C23H43N3O3S/c1-4-5-6-16-19-23(27)26(21(2)3)20-17-14-12-10-8-7-9-11-13-15-18-22-24-29-30(28)25-22/h8,10,21H,4-7,9,11-20H2,1-3H3,(H,24,25)/b10-8-
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n/an/a>500n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM242782
PNG
(US9422318, MV-IV-110-20)
Show SMILES CCCCCCC(=O)N(CCCCCOc1cccc2nc(NC(C)=O)sc12)C(C)C
Show InChI InChI=1S/C24H37N3O3S/c1-5-6-7-9-15-22(29)27(18(2)3)16-10-8-11-17-30-21-14-12-13-20-23(21)31-24(26-20)25-19(4)28/h12-14,18H,5-11,15-17H2,1-4H3,(H,25,26,28)
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n/an/a>500n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50057421
PNG
(CHEMBL3322798 | US9127027, 3 | US9422318, 3)
Show SMILES CCCCNC(=O)C(=O)NCCCC\C=C/CCCCCCC(=O)OCCOCCOCCO
Show InChI InChI=1S/C25H46N2O7/c1-2-3-15-26-24(30)25(31)27-16-13-11-9-7-5-4-6-8-10-12-14-23(29)34-22-21-33-20-19-32-18-17-28/h5,7,28H,2-4,6,8-22H2,1H3,(H,26,30)(H,27,31)/b7-5-
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n/an/a>500n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50057637
PNG
(CHEMBL3322825 | US9422318, 30)
Show SMILES CCCCCCC(=O)N(CCCCCOc1cccc2sc(NC(C)=O)nc12)C(C)C
Show InChI InChI=1S/C24H37N3O3S/c1-5-6-7-9-15-22(29)27(18(2)3)16-10-8-11-17-30-20-13-12-14-21-23(20)26-24(31-21)25-19(4)28/h12-14,18H,5-11,15-17H2,1-4H3,(H,25,26,28)
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n/an/a>500n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM179761
PNG
(US9127027, 27 | US9422318, 27)
Show SMILES CCCCNC(=O)C(=O)NCCCC\C=C/CCCCCCC1=NOS(=O)N1
Show InChI InChI=1S/C19H34N4O4S/c1-2-3-15-20-18(24)19(25)21-16-13-11-9-7-5-4-6-8-10-12-14-17-22-27-28(26)23-17/h5,7H,2-4,6,8-16H2,1H3,(H,20,24)(H,21,25)(H,22,23)/b7-5-
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n/an/a>500n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50057502
PNG
(CHEMBL3322816 | US9127027, 21 | US9422318, 21)
Show SMILES CCCCNC(=O)C(=O)NCCCC\C=C/CCCCCCc1nnn[nH]1
Show InChI InChI=1S/C19H34N6O2/c1-2-3-15-20-18(26)19(27)21-16-13-11-9-7-5-4-6-8-10-12-14-17-22-24-25-23-17/h5,7H,2-4,6,8-16H2,1H3,(H,20,26)(H,21,27)(H,22,23,24,25)/b7-5-
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n/an/a>500n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM62371
PNG
(US9127027, 10)
Show SMILES CCCCCNC(=O)NCCCC\C=C/CCCCCCP([O-])([O-])=O
Show InChI InChI=1S/C18H37N2O4P/c1-2-3-12-15-19-18(21)20-16-13-10-8-6-4-5-7-9-11-14-17-25(22,23)24/h4,6H,2-3,5,7-17H2,1H3,(H2,19,20,21)(H2,22,23,24)/p-2/b6-4-
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n/an/a>500n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


Citation and Details
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50057422
PNG
(CHEMBL3322799 | US9422318, 5)
Show SMILES CCCCCCC(=O)N(CCCC\C=C/CCCCCCC(=O)NCC(O)=O)C(C)C
Show InChI InChI=1S/C25H46N2O4/c1-4-5-6-16-19-24(29)27(22(2)3)20-17-14-12-10-8-7-9-11-13-15-18-23(28)26-21-25(30)31/h8,10,22H,4-7,9,11-21H2,1-3H3,(H,26,28)(H,30,31)/b10-8-
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n/an/a>500n/an/an/an/an/an/a



The Medical College of Wisconsin, Inc.; The Board of Regents of the University of Texas System

US Patent


Assay Description
Compounds were tested for their ability to inhibit recombinant soluble epoxide hydrolase (sEH) protein. The assay utilizes (3-Phhenyl-oxiranyl)-aceti...


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