Compile Data Set for Download or QSAR
Found 616 Enz. Inhib. hit(s) with Target = 'Epoxide hydrolase 1'
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM50327847(1-(1-(Trifluoroacetyl)piperidin-4-yl)-3-(4-(triflu...)
Show SMILES FC(F)(F)Oc1ccc(NC(=O)NC2CCN(CC2)C(=O)C(F)(F)F)cc1
Show InChI InChI=1S/C15H15F6N3O3/c16-14(17,18)12(25)24-7-5-10(6-8-24)23-13(26)22-9-1-3-11(4-2-9)27-15(19,20)21/h1-4,10H,5-8H2,(H2,22,23,26)
Affinity DataIC50: 0.400nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM50327850(1-(1-Tosylpiperidin-4-yl)-3-(4-(trifluoromethoxy)p...)
Show SMILES Cc1ccc(cc1)S(=O)(=O)N1CCC(CC1)NC(=O)Nc1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C20H22F3N3O4S/c1-14-2-8-18(9-3-14)31(28,29)26-12-10-16(11-13-26)25-19(27)24-15-4-6-17(7-5-15)30-20(21,22)23/h2-9,16H,10-13H2,1H3,(H2,24,25,27)
Affinity DataIC50: 0.400nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM2197(US8501783, 1591)
Show SMILES FC(F)(F)Oc1ccc(NC(=O)NC2CCN(CC2)S(=O)(=O)c2ccc(cc2)C(F)(F)F)cc1
Show InChI InChI=1S/C20H19F6N3O4S/c21-19(22,23)13-1-7-17(8-2-13)34(31,32)29-11-9-15(10-12-29)28-18(30)27-14-3-5-16(6-4-14)33-20(24,25)26/h1-8,15H,9-12H2,(H2,27,28,30)
Affinity DataIC50: 0.400nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM50327856(1-(1-(5-(Dimethylamino)naphthalen-1-ylsulfonyl)pip...)
Show SMILES CN(C)c1cccc2c(cccc12)S(=O)(=O)N1CCC(CC1)NC(=O)Nc1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C25H27F3N4O4S/c1-31(2)22-7-3-6-21-20(22)5-4-8-23(21)37(34,35)32-15-13-18(14-16-32)30-24(33)29-17-9-11-19(12-10-17)36-25(26,27)28/h3-12,18H,13-16H2,1-2H3,(H2,29,30,33)
Affinity DataIC50: 0.800nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM100436(US8501783, 1702)
Show SMILES COC(=O)N1CCC(CC1)NC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C18H29N3O3/c1-24-17(23)21-4-2-15(3-5-21)19-16(22)20-18-9-12-6-13(10-18)8-14(7-12)11-18/h12-15H,2-11H2,1H3,(H2,19,20,22)
Affinity DataIC50: 0.900nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM50551715(CHEMBL4741234)
Show SMILES NC(=O)C(SCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)C1CCCC1
Show InChI InChI=1S/C16H17F6NOS/c17-15(18,19)11-5-9(6-12(7-11)16(20,21)22)8-25-13(14(23)24)10-3-1-2-4-10/h5-7,10,13H,1-4,8H2,(H2,23,24)
Affinity DataIC50: 0.940nMAssay Description:Inhibition of tissue extract derived mEH (unknown origin) using [3H]trans-stilbene oxide as substrate by liquid scintillation counting methodMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails PubMed
TargetEpoxide hydrolase 1(Felis catus (Cat) (Felis silvestris catus))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM25741(4-{[4-({[4-(trifluoromethoxy)phenyl]carbamoyl}amin...)
Show SMILES OC(=O)c1ccc(OC2CCC(CC2)NC(=O)Nc2ccc(OC(F)(F)F)cc2)cc1
Show InChI InChI=1S/C21H21F3N2O5/c22-21(23,24)31-18-11-5-15(6-12-18)26-20(29)25-14-3-9-17(10-4-14)30-16-7-1-13(2-8-16)19(27)28/h1-2,5-8,11-12,14,17H,3-4,9-10H2,(H,27,28)(H2,25,26,29)
Affinity DataIC50: 1nMAssay Description:The enzyme also can be detected based on the binding of specific ligands to the catalytic site which either immobilize the enzyme or label it with a ...More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Canis lupus familiaris (Dog) (Canis familiaris))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM25739(4-({4-[(adamantan-1-ylcarbamoyl)amino]cyclohexyl}o...)
Show SMILES OC(=O)c1ccc(OC2CCC(CC2)NC(=O)NC23CC4CC(CC(C4)C2)C3)cc1
Show InChI InChI=1S/C24H32N2O4/c27-22(28)18-1-5-20(6-2-18)30-21-7-3-19(4-8-21)25-23(29)26-24-12-15-9-16(13-24)11-17(10-15)14-24/h1-2,5-6,15-17,19,21H,3-4,7-14H2,(H,27,28)(H2,25,26,29)
Affinity DataIC50: 1nMAssay Description:The enzyme also can be detected based on the binding of specific ligands to the catalytic site which either immobilize the enzyme or label it with a ...More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Felis catus (Cat) (Felis silvestris catus))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM410785(US10383835, Compound 2225 | trans-N-methyl- 4-[4- ...)
Show SMILES CNC(=O)c1ccc(O[C@H]2CCC(CC2)NC(=O)NC23CC4CC(CC(C4)C2)C3)cc1
Show InChI InChI=1S/C25H35N3O3/c1-26-23(29)19-2-6-21(7-3-19)31-22-8-4-20(5-9-22)27-24(30)28-25-13-16-10-17(14-25)12-18(11-16)15-25/h2-3,6-7,16-18,20,22H,4-5,8-15H2,1H3,(H,26,29)(H2,27,28,30)/t16?,17?,18?,20?,22-,25?
Affinity DataIC50: 1nMAssay Description:The enzyme also can be detected based on the binding of specific ligands to the catalytic site which either immobilize the enzyme or label it with a ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM2211(US8501783, 1204 | US8501783, 1211)
Show SMILES COC(=O)c1ccc(cc1)C(=O)N1CCC(CNC(=O)NC23CC4CC(CC(C4)C2)C3)CC1
Show InChI InChI=1S/C26H35N3O4/c1-33-24(31)22-4-2-21(3-5-22)23(30)29-8-6-17(7-9-29)16-27-25(32)28-26-13-18-10-19(14-26)12-20(11-18)15-26/h2-5,17-20H,6-16H2,1H3,(H2,27,28,32)
Affinity DataIC50: 1.10nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM2210(US8501783, 1203 | US8501783, 1209)
Show SMILES COC(=O)c1cccc(c1)C(=O)N1CCC(CNC(=O)NC23CC4CC(CC(C4)C2)C3)CC1
Show InChI InChI=1S/C26H35N3O4/c1-33-24(31)22-4-2-3-21(12-22)23(30)29-7-5-17(6-8-29)16-27-25(32)28-26-13-18-9-19(14-26)11-20(10-18)15-26/h2-4,12,17-20H,5-11,13-16H2,1H3,(H2,27,28,32)
Affinity DataIC50: 1.10nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM100431(US8501783, 1204)
Show SMILES COC(=O)c1ccc(cc1)C(=O)N1CCC(CC1)NC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C25H33N3O4/c1-32-23(30)20-4-2-19(3-5-20)22(29)28-8-6-21(7-9-28)26-24(31)27-25-13-16-10-17(14-25)12-18(11-16)15-25/h2-5,16-18,21H,6-15H2,1H3,(H2,26,27,31)
Affinity DataIC50: 1.10nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM100412(US8501783, 1590)
Show SMILES FC(F)(F)C(=O)N1CCC(CC1)NC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C18H26F3N3O2/c19-18(20,21)15(25)24-3-1-14(2-4-24)22-16(26)23-17-8-11-5-12(9-17)7-13(6-11)10-17/h11-14H,1-10H2,(H2,22,23,26)
Affinity DataIC50: 1.10nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM100430(US8501783, 1201)
Show SMILES O=C(NC1CCN(CC1)C(=O)c1ccccn1)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C22H30N4O2/c27-20(19-3-1-2-6-23-19)26-7-4-18(5-8-26)24-21(28)25-22-12-15-9-16(13-22)11-17(10-15)14-22/h1-3,6,15-18H,4-5,7-14H2,(H2,24,25,28)
Affinity DataIC50: 1.20nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM100428(US8501783, 1159)
Show SMILES O=C(NC1CCN(CC1)C(=O)c1ccccc1)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C23H31N3O2/c27-21(19-4-2-1-3-5-19)26-8-6-20(7-9-26)24-22(28)25-23-13-16-10-17(14-23)12-18(11-16)15-23/h1-5,16-18,20H,6-15H2,(H2,24,25,28)
Affinity DataIC50: 1.30nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM100435(US8501783, 1701)
Show SMILES CS(=O)(=O)N1CCC(CC1)NC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C17H29N3O3S/c1-24(22,23)20-4-2-15(3-5-20)18-16(21)19-17-9-12-6-13(10-17)8-14(7-12)11-17/h12-15H,2-11H2,1H3,(H2,18,19,21)
Affinity DataIC50: 1.40nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM2211(US8501783, 1204 | US8501783, 1211)
Show SMILES COC(=O)c1ccc(cc1)C(=O)N1CCC(CNC(=O)NC23CC4CC(CC(C4)C2)C3)CC1
Show InChI InChI=1S/C26H35N3O4/c1-33-24(31)22-4-2-21(3-5-22)23(30)29-8-6-17(7-9-29)16-27-25(32)28-26-13-18-10-19(14-26)12-20(11-18)15-26/h2-5,17-20H,6-16H2,1H3,(H2,27,28,32)
Affinity DataIC50: 1.5nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM100368(US8501783, 1433)
Show SMILES O=C(NC1CCN(CC1)C(=O)c1ccncc1)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C22H30N4O2/c27-20(18-1-5-23-6-2-18)26-7-3-19(4-8-26)24-21(28)25-22-12-15-9-16(13-22)11-17(10-15)14-22/h1-2,5-6,15-17,19H,3-4,7-14H2,(H2,24,25,28)
Affinity DataIC50: 1.70nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM100425(US8501783, 1606)
Show SMILES FC(F)(F)C(=O)N1CCC(CC1)NC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C18H26F3N3O2/c19-18(20,21)15(25)24-3-1-14(2-4-24)22-16(26)23-17-8-11-5-12(9-17)7-13(6-11)10-17/h11-14H,1-10H2,(H2,22,23,26)
Affinity DataIC50: 1.70nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM100378(US8501783, 1202)
Show SMILES COC(=O)c1ccccc1C(=O)N1CCC(CC1)NC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C25H33N3O4/c1-32-23(30)21-5-3-2-4-20(21)22(29)28-8-6-19(7-9-28)26-24(31)27-25-13-16-10-17(14-25)12-18(11-16)15-25/h2-5,16-19H,6-15H2,1H3,(H2,26,27,31)
Affinity DataIC50: 1.70nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM100383(US8501783, 1210)
Show SMILES COC(=O)c1ccccc1C(=O)N1CCC(CNC(=O)NC23CC4CC(CC(C4)C2)C3)CC1
Show InChI InChI=1S/C26H35N3O4/c1-33-24(31)22-5-3-2-4-21(22)23(30)29-8-6-17(7-9-29)16-27-25(32)28-26-13-18-10-19(14-26)12-20(11-18)15-26/h2-5,17-20H,6-16H2,1H3,(H2,27,28,32)
Affinity DataIC50: 1.80nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM100401(US8501783, 1556)
Show SMILES FC(F)(F)C(=O)N1CCC(CNC(=O)NC23CC4CC(CC(C4)C2)C3)CC1
Show InChI InChI=1S/C19H28F3N3O2/c20-19(21,22)16(26)25-3-1-12(2-4-25)11-23-17(27)24-18-8-13-5-14(9-18)7-15(6-13)10-18/h12-15H,1-11H2,(H2,23,24,27)
Affinity DataIC50: 1.80nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Felis catus (Cat) (Felis silvestris catus))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM158485(US10383835, Compound 2228 | US9029401, 2227)
Show SMILES CNC(=O)c1ccc(O[C@H]2CCC(CC2)NC(=O)Nc2ccc(OC(F)(F)F)cc2)cc1
Show InChI InChI=1S/C22H24F3N3O4/c1-26-20(29)14-2-8-17(9-3-14)31-18-10-4-15(5-11-18)27-21(30)28-16-6-12-19(13-7-16)32-22(23,24)25/h2-3,6-9,12-13,15,18H,4-5,10-11H2,1H3,(H,26,29)(H2,27,28,30)/t15?,18-
Affinity DataIC50: 2nMAssay Description:The enzyme also can be detected based on the binding of specific ligands to the catalytic site which either immobilize the enzyme or label it with a ...More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM100367(US8501783, 1434)
Show SMILES O=C(NC1CCN(CC1)C(=O)c1cccnc1)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C22H30N4O2/c27-20(18-2-1-5-23-14-18)26-6-3-19(4-7-26)24-21(28)25-22-11-15-8-16(12-22)10-17(9-15)13-22/h1-2,5,14-17,19H,3-4,6-13H2,(H2,24,25,28)
Affinity DataIC50: 2.10nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM50551715(CHEMBL4741234)
Show SMILES NC(=O)C(SCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)C1CCCC1
Show InChI InChI=1S/C16H17F6NOS/c17-15(18,19)11-5-9(6-12(7-11)16(20,21)22)8-25-13(14(23)24)10-3-1-2-4-10/h5-7,10,13H,1-4,8H2,(H2,23,24)
Affinity DataIC50: 2.20nMAssay Description:Inhibition of human mEH using CMNGC as substrate preincubated for 5 mins followed by substrate addition and measured at 30 secs interval for 10 mins ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails PubMed
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM100427(US8501783, 1157)
Show SMILES CCCC(=O)N1CCC(CC1)NC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C20H33N3O2/c1-2-3-18(24)23-6-4-17(5-7-23)21-19(25)22-20-11-14-8-15(12-20)10-16(9-14)13-20/h14-17H,2-13H2,1H3,(H2,21,22,25)
Affinity DataIC50: 2.64nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM100377(US8501783, 1206)
Show SMILES COC(=O)CCCC(=O)N1CCC(CC1)NC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C22H35N3O4/c1-29-20(27)4-2-3-19(26)25-7-5-18(6-8-25)23-21(28)24-22-12-15-9-16(13-22)11-17(10-15)14-22/h15-18H,2-14H2,1H3,(H2,23,24,28)
Affinity DataIC50: 2.70nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Canis lupus familiaris (Dog) (Canis familiaris))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM25737(12-[(adamantan-1-ylcarbamoyl)amino]dodecanoic acid...)
Show SMILES OC(=O)CCCCCCCCCCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C23H40N2O3/c26-21(27)10-8-6-4-2-1-3-5-7-9-11-24-22(28)25-23-15-18-12-19(16-23)14-20(13-18)17-23/h18-20H,1-17H2,(H,26,27)(H2,24,25,28)
Affinity DataIC50: 3nMAssay Description:The enzyme also can be detected based on the binding of specific ligands to the catalytic site which either immobilize the enzyme or label it with a ...More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Felis catus (Cat) (Felis silvestris catus))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM25737(12-[(adamantan-1-ylcarbamoyl)amino]dodecanoic acid...)
Show SMILES OC(=O)CCCCCCCCCCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C23H40N2O3/c26-21(27)10-8-6-4-2-1-3-5-7-9-11-24-22(28)25-23-15-18-12-19(16-23)14-20(13-18)17-23/h18-20H,1-17H2,(H,26,27)(H2,24,25,28)
Affinity DataIC50: 3nMAssay Description:The enzyme also can be detected based on the binding of specific ligands to the catalytic site which either immobilize the enzyme or label it with a ...More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM100426(US8501783, 1163)
Show SMILES CCC(=O)N1CCC(CC1)NC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C19H31N3O2/c1-2-17(23)22-5-3-16(4-6-22)20-18(24)21-19-10-13-7-14(11-19)9-15(8-13)12-19/h13-16H,2-12H2,1H3,(H2,20,21,24)
Affinity DataIC50: 3.19nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM100363(US8501783, 1163 | US9296693, 2)
Show SMILES CCC(=O)N1CCC(CC1)NC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C19H31N3O2/c1-2-17(23)22-5-3-16(4-6-22)20-18(24)21-19-10-13-7-14(11-19)9-15(8-13)12-19/h13-16H,2-12H2,1H3,(H2,20,21,24)
Affinity DataIC50: 3.20nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM100372(US8501783, 1121 | US8501783, 165)
Show SMILES O=C(NCC1CCN(CC1)C(=O)c1ccccc1)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C24H33N3O2/c28-22(21-4-2-1-3-5-21)27-8-6-17(7-9-27)16-25-23(29)26-24-13-18-10-19(14-24)12-20(11-18)15-24/h1-5,17-20H,6-16H2,(H2,25,26,29)
Affinity DataIC50: 3.20nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM100390(US8501783, 1523)
Show SMILES OC(=O)c1ccc(cc1)C(=O)N1CCC(CC1)NC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C24H31N3O4/c28-21(18-1-3-19(4-2-18)22(29)30)27-7-5-20(6-8-27)25-23(31)26-24-12-15-9-16(13-24)11-17(10-15)14-24/h1-4,15-17,20H,5-14H2,(H,29,30)(H2,25,26,31)
Affinity DataIC50: 3.30nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM100382(US8501783, 1212)
Show SMILES COC(=O)CCCC(=O)N1CCC(CNC(=O)NC23CC4CC(CC(C4)C2)C3)CC1
Show InChI InChI=1S/C23H37N3O4/c1-30-21(28)4-2-3-20(27)26-7-5-16(6-8-26)15-24-22(29)25-23-12-17-9-18(13-23)11-19(10-17)14-23/h16-19H,2-15H2,1H3,(H2,24,25,29)
Affinity DataIC50: 3.40nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Felis catus (Cat) (Felis silvestris catus))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM158487(US10383835, Compound 2226 | US9029401, 2253)
Show SMILES CNC(=O)c1ccc(O[C@H]2CCC(CC2)NC(=O)Nc2ccc(Cl)c(c2)C(F)(F)F)cc1
Show InChI InChI=1S/C22H23ClF3N3O3/c1-27-20(30)13-2-7-16(8-3-13)32-17-9-4-14(5-10-17)28-21(31)29-15-6-11-19(23)18(12-15)22(24,25)26/h2-3,6-8,11-12,14,17H,4-5,9-10H2,1H3,(H,27,30)(H2,28,29,31)/t14?,17-
Affinity DataIC50: 4nMAssay Description:The enzyme also can be detected based on the binding of specific ligands to the catalytic site which either immobilize the enzyme or label it with a ...More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Canis lupus familiaris (Dog) (Canis familiaris))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM25741(4-{[4-({[4-(trifluoromethoxy)phenyl]carbamoyl}amin...)
Show SMILES OC(=O)c1ccc(OC2CCC(CC2)NC(=O)Nc2ccc(OC(F)(F)F)cc2)cc1
Show InChI InChI=1S/C21H21F3N2O5/c22-21(23,24)31-18-11-5-15(6-12-18)26-20(29)25-14-3-9-17(10-4-14)30-16-7-1-13(2-8-16)19(27)28/h1-2,5-8,11-12,14,17H,3-4,9-10H2,(H,27,28)(H2,25,26,29)
Affinity DataIC50: 4nMAssay Description:The enzyme also can be detected based on the binding of specific ligands to the catalytic site which either immobilize the enzyme or label it with a ...More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM2210(US8501783, 1203 | US8501783, 1209)
Show SMILES COC(=O)c1cccc(c1)C(=O)N1CCC(CNC(=O)NC23CC4CC(CC(C4)C2)C3)CC1
Show InChI InChI=1S/C26H35N3O4/c1-33-24(31)22-4-2-3-21(12-22)23(30)29-7-5-17(6-8-29)16-27-25(32)28-26-13-18-9-19(14-26)11-20(10-18)15-26/h2-4,12,17-20H,5-11,13-16H2,1H3,(H2,27,28,32)
Affinity DataIC50: 4.10nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM100398(US8501783, 1551)
Show SMILES CC(C)(C)OC(=O)N1CCC(CC1)NC(=O)NC1CCCCC1
Show InChI InChI=1S/C17H31N3O3/c1-17(2,3)23-16(22)20-11-9-14(10-12-20)19-15(21)18-13-7-5-4-6-8-13/h13-14H,4-12H2,1-3H3,(H2,18,19,21)
Affinity DataIC50: 4.30nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM50551714(CHEMBL4761537)
Show SMILES CC(SC(C1CCCC1)C(N)=O)c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C16H20F3NOS/c1-10(12-7-4-8-13(9-12)16(17,18)19)22-14(15(20)21)11-5-2-3-6-11/h4,7-11,14H,2-3,5-6H2,1H3,(H2,20,21)
Affinity DataIC50: 4.70nMAssay Description:Inhibition of human mEH using CMNGC as substrate preincubated for 5 mins followed by substrate addition and measured at 30 secs interval for 10 mins ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails PubMed
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM100415(US8501783, 1605)
Show SMILES O=C(NC1CCN(CC1)C(=O)c1ccccc1)NC1CCN(CC1)C(=O)c1ccccc1
Show InChI InChI=1S/C25H30N4O3/c30-23(19-7-3-1-4-8-19)28-15-11-21(12-16-28)26-25(32)27-22-13-17-29(18-14-22)24(31)20-9-5-2-6-10-20/h1-10,21-22H,11-18H2,(H2,26,27,32)
Affinity DataIC50: 4.80nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Felis catus (Cat) (Felis silvestris catus))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM25741(4-{[4-({[4-(trifluoromethoxy)phenyl]carbamoyl}amin...)
Show SMILES OC(=O)c1ccc(OC2CCC(CC2)NC(=O)Nc2ccc(OC(F)(F)F)cc2)cc1
Show InChI InChI=1S/C21H21F3N2O5/c22-21(23,24)31-18-11-5-15(6-12-18)26-20(29)25-14-3-9-17(10-4-14)30-16-7-1-13(2-8-16)19(27)28/h1-2,5-8,11-12,14,17H,3-4,9-10H2,(H,27,28)(H2,25,26,29)
Affinity DataIC50: 5nMAssay Description:The enzyme also can be detected based on the binding of specific ligands to the catalytic site which either immobilize the enzyme or label it with a ...More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM100369(US8501783, 1156)
Show SMILES CC(=O)N1CCC(CNC(=O)NC23CC4CC(CC(C4)C2)C3)CC1
Show InChI InChI=1S/C19H31N3O2/c1-13(23)22-4-2-14(3-5-22)12-20-18(24)21-19-9-15-6-16(10-19)8-17(7-15)11-19/h14-17H,2-12H2,1H3,(H2,20,21,24)
Affinity DataIC50: 5nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM100375(US8501783, 1435)
Show SMILES O=C(NCC1CCN(CC1)C(=O)c1ccncc1)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C23H32N4O2/c28-21(20-1-5-24-6-2-20)27-7-3-16(4-8-27)15-25-22(29)26-23-12-17-9-18(13-23)11-19(10-17)14-23/h1-2,5-6,16-19H,3-4,7-15H2,(H2,25,26,29)
Affinity DataIC50: 5.40nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Felis catus (Cat) (Felis silvestris catus))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM25739(4-({4-[(adamantan-1-ylcarbamoyl)amino]cyclohexyl}o...)
Show SMILES OC(=O)c1ccc(OC2CCC(CC2)NC(=O)NC23CC4CC(CC(C4)C2)C3)cc1
Show InChI InChI=1S/C24H32N2O4/c27-22(28)18-1-5-20(6-2-18)30-21-7-3-19(4-8-21)25-23(29)26-24-12-15-9-16(13-24)11-17(10-15)14-24/h1-2,5-6,15-17,19,21H,3-4,7-14H2,(H,27,28)(H2,25,26,29)
Affinity DataIC50: 6nMAssay Description:The enzyme also can be detected based on the binding of specific ligands to the catalytic site which either immobilize the enzyme or label it with a ...More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM100381(US8501783, 1208)
Show SMILES COC(=O)CCC(=O)N1CCC(CNC(=O)NC23CC4CC(CC(C4)C2)C3)CC1
Show InChI InChI=1S/C22H35N3O4/c1-29-20(27)3-2-19(26)25-6-4-15(5-7-25)14-23-21(28)24-22-11-16-8-17(12-22)10-18(9-16)13-22/h15-18H,2-14H2,1H3,(H2,23,24,28)
Affinity DataIC50: 6.20nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM100371(US8501783, 1120)
Show SMILES CCCC(=O)N1CCC(CNC(=O)NC23CC4CC(CC(C4)C2)C3)CC1
Show InChI InChI=1S/C21H35N3O2/c1-2-3-19(25)24-6-4-15(5-7-24)14-22-20(26)23-21-11-16-8-17(12-21)10-18(9-16)13-21/h15-18H,2-14H2,1H3,(H2,22,23,26)
Affinity DataIC50: 6.70nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM100374(US8501783, 1436)
Show SMILES O=C(NCC1CCN(CC1)C(=O)c1cccnc1)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C23H32N4O2/c28-21(20-2-1-5-24-15-20)27-6-3-16(4-7-27)14-25-22(29)26-23-11-17-8-18(12-23)10-19(9-17)13-23/h1-2,5,15-19H,3-4,6-14H2,(H2,25,26,29)
Affinity DataIC50: 7.30nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM100373(US8501783, 1207)
Show SMILES O=C(NCC1CCN(CC1)C(=O)c1ccccn1)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C23H32N4O2/c28-21(20-3-1-2-6-24-20)27-7-4-16(5-8-27)15-25-22(29)26-23-12-17-9-18(13-23)11-19(10-17)14-23/h1-3,6,16-19H,4-5,7-15H2,(H2,25,26,29)
Affinity DataIC50: 7.60nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM100357(US10383835, Compound 3d | US11123311, Compound 3d ...)
Show SMILES O=C(NC1CCN(Cc2ccccc2)CC1)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C23H33N3O/c27-22(25-23-13-18-10-19(14-23)12-20(11-18)15-23)24-21-6-8-26(9-7-21)16-17-4-2-1-3-5-17/h1-5,18-21H,6-16H2,(H2,24,25,27)
Affinity DataIC50: 8.40nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
TargetEpoxide hydrolase 1(Homo sapiens (Human))
The Regents of the University of California

US Patent
LigandPNGBDBM100370(US8501783, 1162)
Show SMILES CCC(=O)N1CCC(CNC(=O)NC23CC4CC(CC(C4)C2)C3)CC1
Show InChI InChI=1S/C20H33N3O2/c1-2-18(24)23-5-3-14(4-6-23)13-21-19(25)22-20-10-15-7-16(11-20)9-17(8-15)12-20/h14-17H,2-13H2,1H3,(H2,21,22,25)
Affinity DataIC50: 8.70nMAssay Description:Inhibition assay of human soluble epoxide hydrolases.More data for this Ligand-Target Pair
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