Compile Data Set for Download or QSAR
Found 64 Enz. Inhib. hit(s) with all data for assayid = 1 entry = 10155
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM409020(US10377744, Compound No. 40 | US11123311, Compound...)
Show SMILES CCOC(=O)N1CCC(CC1)NC(=O)Nc1ccc(OC(F)(F)F)c(F)c1
Show InChI InChI=1S/C16H19F4N3O4/c1-2-26-15(25)23-7-5-10(6-8-23)21-14(24)22-11-3-4-13(12(17)9-11)27-16(18,19)20/h3-4,9-10H,2,5-8H2,1H3,(H2,21,22,24)
Affinity DataKi: <0.0500nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM409005(US10377744, Compound No. 26 | US11123311, Compound...)
Show SMILES CC[C@H](C)C(=O)N1CCC(CC1)NC(=O)Nc1ccc(OC(F)(F)F)c(F)c1
Show InChI InChI=1S/C18H23F4N3O3/c1-3-11(2)16(26)25-8-6-12(7-9-25)23-17(27)24-13-4-5-15(14(19)10-13)28-18(20,21)22/h4-5,10-12H,3,6-9H2,1-2H3,(H2,23,24,27)/t11-/m0/s1
Affinity DataKi: <0.0500nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM517699(US11123311, Compound 28)
Show SMILES FC(F)(F)Oc1ccc(NC(=O)NC2CCN(CC2)C(=O)C2(CC2)C(F)(F)F)cc1
Show InChI InChI=1S/C18H19F6N3O3/c19-17(20,21)16(7-8-16)14(28)27-9-5-12(6-10-27)26-15(29)25-11-1-3-13(4-2-11)30-18(22,23)24/h1-4,12H,5-10H2,(H2,25,26,29)
Affinity DataKi:  0.0500nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM409009(US10377744, Compound No. 30 | US11123311, Compound...)
Show SMILES Fc1cc(NC(=O)NC2CCN(CC2)C(=O)C2(CC2)C(F)(F)F)ccc1OC(F)(F)F
Show InChI InChI=1S/C18H18F7N3O3/c19-12-9-11(1-2-13(12)31-18(23,24)25)27-15(30)26-10-3-7-28(8-4-10)14(29)16(5-6-16)17(20,21)22/h1-2,9-10H,3-8H2,(H2,26,27,30)
Affinity DataKi: <0.0500nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM409030(US10377744, Compound No. 51 | US11123311, Compound...)
Show SMILES CCC(C)C(=O)N1CCC(CC1)NC(=O)Nc1ccc(OC(F)(F)F)c(F)c1
Show InChI InChI=1S/C18H23F4N3O3/c1-3-11(2)16(26)25-8-6-12(7-9-25)23-17(27)24-13-4-5-15(14(19)10-13)28-18(20,21)22/h4-5,10-12H,3,6-9H2,1-2H3,(H2,23,24,27)
Affinity DataKi:  0.0600nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM409016(US10377744, Compound No. 36 | US11123311, Compound...)
Show SMILES Fc1cc(NC(=O)NC2CCN(CC2)C(=O)C2(CC2)C(F)(F)F)ccc1C(F)(F)F
Show InChI InChI=1S/C18H18F7N3O2/c19-13-9-11(1-2-12(13)17(20,21)22)27-15(30)26-10-3-7-28(8-4-10)14(29)16(5-6-16)18(23,24)25/h1-2,9-10H,3-8H2,(H2,26,27,30)
Affinity DataKi:  0.0800nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM409003(US10377744, Compound No. 24 | US11123311, Compound...)
Show SMILES Fc1cc(NC(=O)NC2CCN(CC2)C(=O)C2CC2)ccc1OC(F)(F)F
Show InChI InChI=1S/C17H19F4N3O3/c18-13-9-12(3-4-14(13)27-17(19,20)21)23-16(26)22-11-5-7-24(8-6-11)15(25)10-1-2-10/h3-4,9-11H,1-2,5-8H2,(H2,22,23,26)
Affinity DataKi:  0.150nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM408992(US10377744, Compound No. 13 | US10377744, Compound...)
Show SMILES Cc1occc1C(=O)N1CCC(CC1)NC(=O)Nc1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C19H20F3N3O3/c1-12-16(8-11-28-12)17(26)25-9-6-15(7-10-25)24-18(27)23-14-4-2-13(3-5-14)19(20,21)22/h2-5,8,11,15H,6-7,9-10H2,1H3,(H2,23,24,27)
Affinity DataKi:  0.220nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM408986(US10377744, Compound No. 7 | US11123311, Compound ...)
Show SMILES Cc1ccoc1C(=O)N1CCC(CC1)NC(=O)Nc1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C19H20F3N3O4/c1-12-8-11-28-16(12)17(26)25-9-6-14(7-10-25)24-18(27)23-13-2-4-15(5-3-13)29-19(20,21)22/h2-5,8,11,14H,6-7,9-10H2,1H3,(H2,23,24,27)
Affinity DataKi:  0.260nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM50100520(CHEMBL3327077 | US10377744, Compound No. 2422 | US...)
Show SMILES CC(C)C(=O)N1CCC(CC1)NC(=O)Nc1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C17H22F3N3O3/c1-11(2)15(24)23-9-7-13(8-10-23)22-16(25)21-12-3-5-14(6-4-12)26-17(18,19)20/h3-6,11,13H,7-10H2,1-2H3,(H2,21,22,25)
Affinity DataKi:  0.310nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM408998(US10377744, Compound No. 19 | US11123311, Compound...)
Show SMILES CC(C)C(=O)N1CCC(CC1)NC(=O)Nc1ccc(OC(F)(F)F)c(F)c1
Show InChI InChI=1S/C17H21F4N3O3/c1-10(2)15(25)24-7-5-11(6-8-24)22-16(26)23-12-3-4-14(13(18)9-12)27-17(19,20)21/h3-4,9-11H,5-8H2,1-2H3,(H2,22,23,26)
Affinity DataKi:  0.310nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM408982(US10377744, Compound No. 3 | US11123311, Compound ...)
Show SMILES FC(F)(F)Oc1ccc(NC(=O)NC2CCN(CC2)C(=O)c2ccoc2)cc1
Show InChI InChI=1S/C18H18F3N3O4/c19-18(20,21)28-15-3-1-13(2-4-15)22-17(26)23-14-5-8-24(9-6-14)16(25)12-7-10-27-11-12/h1-4,7,10-11,14H,5-6,8-9H2,(H2,22,23,26)
Affinity DataKi:  0.330nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM409014(US10377744, Compound No. 34 | US10377744, Syn34 | ...)
Show SMILES CC[C@H](C)C(=O)N1CCC(CC1)NC(=O)Nc1ccc(c(F)c1)C(F)(F)F
Show InChI InChI=1S/C18H23F4N3O2/c1-3-11(2)16(26)25-8-6-12(7-9-25)23-17(27)24-13-4-5-14(15(19)10-13)18(20,21)22/h4-5,10-12H,3,6-9H2,1-2H3,(H2,23,24,27)/t11-/m0/s1
Affinity DataKi:  0.370nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM409012(US10377744, Compound No. 32 | US11123311, Compound...)
Show SMILES Fc1cc(NC(=O)NC2CCN(CC2)C(=O)C2CC2)ccc1C(F)(F)F
Show InChI InChI=1S/C17H19F4N3O2/c18-14-9-12(3-4-13(14)17(19,20)21)23-16(26)22-11-5-7-24(8-6-11)15(25)10-1-2-10/h3-4,9-11H,1-2,5-8H2,(H2,22,23,26)
Affinity DataKi:  0.380nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM409021(US10377744, Compound No. 41 | US11123311, Compound...)
Show SMILES CCOC(=O)N1CCC(CC1)NC(=O)Nc1ccc(c(F)c1)C(F)(F)F
Show InChI InChI=1S/C16H19F4N3O3/c1-2-26-15(25)23-7-5-10(6-8-23)21-14(24)22-11-3-4-12(13(17)9-11)16(18,19)20/h3-4,9-10H,2,5-8H2,1H3,(H2,21,22,24)
Affinity DataKi:  0.380nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM408999(US10377744, Compound No. 20 | US11123311, Compound...)
Show SMILES CC(C)C(=O)N1CCC(CC1)NC(=O)Nc1ccc(c(F)c1)C(F)(F)F
Show InChI InChI=1S/C17H21F4N3O2/c1-10(2)15(25)24-7-5-11(6-8-24)22-16(26)23-12-3-4-13(14(18)9-12)17(19,20)21/h3-4,9-11H,5-8H2,1-2H3,(H2,22,23,26)
Affinity DataKi:  0.490nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM408995(US10377744, Compound No. 16 | US11123311, Compound...)
Show SMILES FC(F)(F)c1ccc(NC(=O)NC2CCN(CC2)C(=O)c2cc[nH]c2)cc1
Show InChI InChI=1S/C18H19F3N4O2/c19-18(20,21)13-1-3-14(4-2-13)23-17(27)24-15-6-9-25(10-7-15)16(26)12-5-8-22-11-12/h1-5,8,11,15,22H,6-7,9-10H2,(H2,23,24,27)
Affinity DataKi:  0.5nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM408992(US10377744, Compound No. 13 | US10377744, Compound...)
Show SMILES Cc1occc1C(=O)N1CCC(CC1)NC(=O)Nc1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C19H20F3N3O3/c1-12-16(8-11-28-12)17(26)25-9-6-15(7-10-25)24-18(27)23-14-4-2-13(3-5-14)19(20,21)22/h2-5,8,11,15H,6-7,9-10H2,1H3,(H2,23,24,27)
Affinity DataKi:  0.510nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM408985(US10377744, Compound No. 6 | US11123311, Compound ...)
Show SMILES Cc1occc1C(=O)N1CCC(CC1)NC(=O)Nc1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C19H20F3N3O4/c1-12-16(8-11-28-12)17(26)25-9-6-14(7-10-25)24-18(27)23-13-2-4-15(5-3-13)29-19(20,21)22/h2-5,8,11,14H,6-7,9-10H2,1H3,(H2,23,24,27)
Affinity DataKi:  0.550nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM408981(US10377744, Compound No. 2 | US11123311, Compound ...)
Show SMILES FC(F)(F)Oc1ccc(NC(=O)NC2CCN(CC2)C(=O)c2cc[nH]c2)cc1
Show InChI InChI=1S/C18H19F3N4O3/c19-18(20,21)28-15-3-1-13(2-4-15)23-17(27)24-14-6-9-25(10-7-14)16(26)12-5-8-22-11-12/h1-5,8,11,14,22H,6-7,9-10H2,(H2,23,24,27)
Affinity DataKi:  0.640nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM50100520(CHEMBL3327077 | US10377744, Compound No. 2422 | US...)
Show SMILES CC(C)C(=O)N1CCC(CC1)NC(=O)Nc1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C17H22F3N3O3/c1-11(2)15(24)23-9-7-13(8-10-23)22-16(25)21-12-3-5-14(6-4-12)26-17(18,19)20/h3-6,11,13H,7-10H2,1-2H3,(H2,21,22,25)
Affinity DataKi:  0.660nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM409004(US10377744, Compound No. 25 | US11123311, Compound...)
Show SMILES Fc1cc(NC(=O)NC2CCN(CC2)C(=O)[C@@H]2CCOC2)ccc1OC(F)(F)F
Show InChI InChI=1S/C18H21F4N3O4/c19-14-9-13(1-2-15(14)29-18(20,21)22)24-17(27)23-12-3-6-25(7-4-12)16(26)11-5-8-28-10-11/h1-2,9,11-12H,3-8,10H2,(H2,23,24,27)/t11-/m1/s1
Affinity DataKi:  0.700nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM409023(US10377744, Compound No. 43 | US11123311, Compound...)
Show SMILES Fc1cc(NC(=O)NC2CCN(CC2)C(=O)N2CCOCC2)ccc1OC(F)(F)F
Show InChI InChI=1S/C18H22F4N4O4/c19-14-11-13(1-2-15(14)30-18(20,21)22)24-16(27)23-12-3-5-25(6-4-12)17(28)26-7-9-29-10-8-26/h1-2,11-12H,3-10H2,(H2,23,24,27)
Affinity DataKi:  0.700nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM409008(US10377744, Compound No. 29 | US11123311, Compound...)
Show SMILES Fc1cc(NC(=O)NC2CCN(CC2)C(=O)C2CCOCC2)ccc1OC(F)(F)F
Show InChI InChI=1S/C19H23F4N3O4/c20-15-11-14(1-2-16(15)30-19(21,22)23)25-18(28)24-13-3-7-26(8-4-13)17(27)12-5-9-29-10-6-12/h1-2,11-13H,3-10H2,(H2,24,25,28)
Affinity DataKi:  0.75nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM408984(US10377744, Compound No. 5 | US11123311, Compound ...)
Show SMILES FC(F)(F)Oc1ccc(NC(=O)NC2CCN(CC2)C(=O)C2=COCC2)cc1
Show InChI InChI=1S/C18H20F3N3O4/c19-18(20,21)28-15-3-1-13(2-4-15)22-17(26)23-14-5-8-24(9-6-14)16(25)12-7-10-27-11-12/h1-4,11,14H,5-10H2,(H2,22,23,26)
Affinity DataKi:  0.770nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM409006(US10377744, Compound No. 27 | US11123311, Compound...)
Show SMILES Fc1cc(NC(=O)NC2CCN(CC2)C(=O)C2CCCOC2)ccc1OC(F)(F)F
Show InChI InChI=1S/C19H23F4N3O4/c20-15-10-14(3-4-16(15)30-19(21,22)23)25-18(28)24-13-5-7-26(8-6-13)17(27)12-2-1-9-29-11-12/h3-4,10,12-13H,1-2,5-9,11H2,(H2,24,25,28)
Affinity DataKi:  0.780nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM409002(US10377744, Compound No. 23 | US11123311, Compound...)
Show SMILES CCC(=O)N1CCC(CC1)NC(=O)Nc1ccc(OC(F)(F)F)c(F)c1
Show InChI InChI=1S/C16H19F4N3O3/c1-2-14(24)23-7-5-10(6-8-23)21-15(25)22-11-3-4-13(12(17)9-11)26-16(18,19)20/h3-4,9-10H,2,5-8H2,1H3,(H2,21,22,25)
Affinity DataKi:  0.870nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM50327809(1-(1-Propionylpiperidin-4-yl)-3-(4-(trifluorometho...)
Show SMILES CCC(=O)N1CCC(CC1)NC(=O)Nc1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C16H20F3N3O3/c1-2-14(23)22-9-7-12(8-10-22)21-15(24)20-11-3-5-13(6-4-11)25-16(17,18)19/h3-6,12H,2,7-10H2,1H3,(H2,20,21,24)
Affinity DataKi:  0.910nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM408991(US10377744, Compound No. 12 | US11123311, Compound...)
Show SMILES FC(F)(F)c1ccc(NC(=O)NC2CCN(CC2)C(=O)C2=COCC2)cc1
Show InChI InChI=1S/C18H20F3N3O3/c19-18(20,21)13-1-3-14(4-2-13)22-17(26)23-15-5-8-24(9-6-15)16(25)12-7-10-27-11-12/h1-4,11,15H,5-10H2,(H2,22,23,26)
Affinity DataKi:  1.03nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM408990(US10377744, Compound No. 11 | US11123311, Compound...)
Show SMILES FC(F)(F)c1ccc(NC(=O)NC2CCN(CC2)C(=O)[C@@H]2CCOC2)cc1
Show InChI InChI=1S/C18H22F3N3O3/c19-18(20,21)13-1-3-14(4-2-13)22-17(26)23-15-5-8-24(9-6-15)16(25)12-7-10-27-11-12/h1-4,12,15H,5-11H2,(H2,22,23,26)/t12-/m1/s1
Affinity DataKi:  1.19nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM408989(US10377744, Compound No. 10 | US11123311, Compound...)
Show SMILES FC(F)(F)c1ccc(NC(=O)NC2CCN(CC2)C(=O)c2ccoc2)cc1
Show InChI InChI=1S/C18H18F3N3O3/c19-18(20,21)13-1-3-14(4-2-13)22-17(26)23-15-5-8-24(9-6-15)16(25)12-7-10-27-11-12/h1-4,7,10-11,15H,5-6,8-9H2,(H2,22,23,26)
Affinity DataKi:  1.21nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM408978(US10377744, Compound No. 1 | US11123311, Compound ...)
Show SMILES FC(F)(F)Oc1ccc(NC(=O)NC2CCN(CC2)C(=O)C2CCOCC2)cc1
Show InChI InChI=1S/C19H24F3N3O4/c20-19(21,22)29-16-3-1-14(2-4-16)23-18(27)24-15-5-9-25(10-6-15)17(26)13-7-11-28-12-8-13/h1-4,13,15H,5-12H2,(H2,23,24,27)
Affinity DataKi:  1.40nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM408983(US10377744, Compound No. 4 | US11123311, Compound ...)
Show SMILES FC(F)(F)Oc1ccc(NC(=O)NC2CCN(CC2)C(=O)[C@@H]2CCOC2)cc1
Show InChI InChI=1S/C18H22F3N3O4/c19-18(20,21)28-15-3-1-13(2-4-15)22-17(26)23-14-5-8-24(9-6-14)16(25)12-7-10-27-11-12/h1-4,12,14H,5-11H2,(H2,22,23,26)/t12-/m1/s1
Affinity DataKi:  1.41nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM408996(US10377744, Compound No. 17 | US11123311, Compound...)
Show SMILES FC(F)(F)Oc1ccc(NC(=O)NC2CCN(CC2)C(=O)C2CCOC2)cc1
Show InChI InChI=1S/C18H22F3N3O4/c19-18(20,21)28-15-3-1-13(2-4-15)22-17(26)23-14-5-8-24(9-6-14)16(25)12-7-10-27-11-12/h1-4,12,14H,5-11H2,(H2,22,23,26)
Affinity DataKi:  1.70nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM408988(US10377744, Compound No. 9 | US11123311, Compound ...)
Show SMILES FC(F)(F)c1ccc(NC(=O)NC2CCN(CC2)C(=O)C2CCOCC2)cc1
Show InChI InChI=1S/C19H24F3N3O3/c20-19(21,22)14-1-3-15(4-2-14)23-18(27)24-16-5-9-25(10-6-16)17(26)13-7-11-28-12-8-13/h1-4,13,16H,5-12H2,(H2,23,24,27)
Affinity DataKi:  1.73nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM408997(US10377744, Compound No. 18 | US11123311, Compound...)
Show SMILES FC(F)(F)c1ccc(NC(=O)NC2CCN(CC2)C(=O)C2CCOC2)cc1
Show InChI InChI=1S/C18H22F3N3O3/c19-18(20,21)13-1-3-14(4-2-13)22-17(26)23-15-5-8-24(9-6-15)16(25)12-7-10-27-11-12/h1-4,12,15H,5-11H2,(H2,22,23,26)
Affinity DataKi:  1.74nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM409018(US10377744, Compound No. 38 | US11123311, Compound...)
Show SMILES Fc1cc(NC(=O)Nc2ccc(OC(F)(F)F)c(F)c2)ccc1OC(F)(F)F
Show InChI InChI=1S/C15H8F8N2O3/c16-9-5-7(1-3-11(9)27-14(18,19)20)24-13(26)25-8-2-4-12(10(17)6-8)28-15(21,22)23/h1-6H,(H2,24,25,26)
Affinity DataKi:  1.95nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM408987(US10377744, Compound No. 8 | US11123311, Compound ...)
Show SMILES FC(F)(F)Oc1ccc(NC(=O)NC2CCN(CC2)C(=O)C2CCCOC2)cc1
Show InChI InChI=1S/C19H24F3N3O4/c20-19(21,22)29-16-5-3-14(4-6-16)23-18(27)24-15-7-9-25(10-8-15)17(26)13-2-1-11-28-12-13/h3-6,13,15H,1-2,7-12H2,(H2,23,24,27)
Affinity DataKi:  1.99nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM409013(US10377744, Compound No. 33 | US11123311, Compound...)
Show SMILES Fc1cc(NC(=O)NC2CCN(CC2)C(=O)C2CCOC2)ccc1C(F)(F)F
Show InChI InChI=1S/C18H21F4N3O3/c19-15-9-13(1-2-14(15)18(20,21)22)24-17(27)23-12-3-6-25(7-4-12)16(26)11-5-8-28-10-11/h1-2,9,11-12H,3-8,10H2,(H2,23,24,27)
Affinity DataKi:  2.09nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM408994(US10377744, Compound No. 15 | US11123311, Compound...)
Show SMILES FC(F)(F)c1ccc(NC(=O)NC2CCN(CC2)C(=O)C2CCCOC2)cc1
Show InChI InChI=1S/C19H24F3N3O3/c20-19(21,22)14-3-5-15(6-4-14)23-18(27)24-16-7-9-25(10-8-16)17(26)13-2-1-11-28-12-13/h3-6,13,16H,1-2,7-12H2,(H2,23,24,27)
Affinity DataKi:  2.40nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM409015(US10377744, Compound No. 35 | US11123311, Compound...)
Show SMILES Fc1cc(NC(=O)NC2CCN(CC2)C(=O)C2CCCOC2)ccc1C(F)(F)F
Show InChI InChI=1S/C19H23F4N3O3/c20-16-10-14(3-4-15(16)19(21,22)23)25-18(28)24-13-5-7-26(8-6-13)17(27)12-2-1-9-29-11-12/h3-4,10,12-13H,1-2,5-9,11H2,(H2,24,25,28)
Affinity DataKi:  2.66nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM409011(US10377744, Compound No. 31 | US11123311, Compound...)
Show SMILES CCC(=O)N1CCC(CC1)NC(=O)Nc1ccc(c(F)c1)C(F)(F)F
Show InChI InChI=1S/C16H19F4N3O2/c1-2-14(24)23-7-5-10(6-8-23)21-15(25)22-11-3-4-12(13(17)9-11)16(18,19)20/h3-4,9-10H,2,5-8H2,1H3,(H2,21,22,25)
Affinity DataKi:  2.94nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM409029(US10377744, Compound No. 49 | US11123311, Compound...)
Show SMILES CC[C@H](C)C(=O)N1CCC(CC(=O)Nc2ccc(OC(F)(F)F)c(F)c2)CC1
Show InChI InChI=1S/C19H24F4N2O3/c1-3-12(2)18(27)25-8-6-13(7-9-25)10-17(26)24-14-4-5-16(15(20)11-14)28-19(21,22)23/h4-5,11-13H,3,6-10H2,1-2H3,(H,24,26)/t12-/m0/s1
Affinity DataKi:  3.14nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM409024(US10377744, Compound No. 44 | US11123311, Compound...)
Show SMILES CC[C@H](C)C(=O)N1CCC(CC1)NC(=O)Nc1ccc(OC(F)(F)F)c(Cl)c1
Show InChI InChI=1S/C18H23ClF3N3O3/c1-3-11(2)16(26)25-8-6-12(7-9-25)23-17(27)24-13-4-5-15(14(19)10-13)28-18(20,21)22/h4-5,10-12H,3,6-9H2,1-2H3,(H2,23,24,27)/t11-/m0/s1
Affinity DataKi:  3.35nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM409025(US10377744, Compound No. 45 | US11123311, Compound...)
Show SMILES CC[C@H](C)C(=O)N1CCC(CC1)NC(=O)Nc1ccc(OC(F)(F)F)c(Br)c1
Show InChI InChI=1S/C18H23BrF3N3O3/c1-3-11(2)16(26)25-8-6-12(7-9-25)23-17(27)24-13-4-5-15(14(19)10-13)28-18(20,21)22/h4-5,10-12H,3,6-9H2,1-2H3,(H2,23,24,27)/t11-/m0/s1
Affinity DataKi:  3.40nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM409017(US10377744, Compound No. 37 | US11123311, Compound...)
Show SMILES Fc1cc(NC(=O)NC2CCN(CC2)C(=O)C2CCOCC2)ccc1C(F)(F)F
Show InChI InChI=1S/C19H23F4N3O3/c20-16-11-14(1-2-15(16)19(21,22)23)25-18(28)24-13-3-7-26(8-4-13)17(27)12-5-9-29-10-6-12/h1-2,11-13H,3-10H2,(H2,24,25,28)
Affinity DataKi:  3.83nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM409000(US10377744, Compound No. 21 | US11123311, Compound...)
Show SMILES CC(C)C(=O)N1CCC(CC(=O)Nc2ccc(OC(F)(F)F)c(F)c2)CC1
Show InChI InChI=1S/C18H22F4N2O3/c1-11(2)17(26)24-7-5-12(6-8-24)9-16(25)23-13-3-4-15(14(19)10-13)27-18(20,21)22/h3-4,10-12H,5-9H2,1-2H3,(H,23,25)
Affinity DataKi:  4.72nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM409028(US10377744, Compound No. 48 | US11123311, Compound...)
Show SMILES Fc1cc(NC(=O)CC2CCN(CC2)C(=O)C2CC2)ccc1OC(F)(F)F
Show InChI InChI=1S/C18H20F4N2O3/c19-14-10-13(3-4-15(14)27-18(20,21)22)23-16(25)9-11-5-7-24(8-6-11)17(26)12-1-2-12/h3-4,10-12H,1-2,5-9H2,(H,23,25)
Affinity DataKi:  6.60nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM409027(US10377744, Compound No. 47 | US11123311, Compound...)
Show SMILES CC[C@H](C)C(=O)N1CCC(CC1)NC(=O)Nc1ccc(OC(F)(F)F)c(OC(F)(F)F)c1
Show InChI InChI=1S/C19H23F6N3O4/c1-3-11(2)16(29)28-8-6-12(7-9-28)26-17(30)27-13-4-5-14(31-18(20,21)22)15(10-13)32-19(23,24)25/h4-5,10-12H,3,6-9H2,1-2H3,(H2,26,27,30)/t11-/m0/s1
Affinity DataKi:  9.07nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetBifunctional epoxide hydrolase 2(Homo sapiens (Human))
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent
LigandPNGBDBM409026(US10377744, Compound No. 46 | US11123311, Compound...)
Show SMILES CC[C@H](C)C(=O)N1CCC(CC1)NC(=O)Nc1ccc(OC(F)(F)F)c(c1)C(F)(F)F
Show InChI InChI=1S/C19H23F6N3O3/c1-3-11(2)16(29)28-8-6-12(7-9-28)26-17(30)27-13-4-5-15(31-19(23,24)25)14(10-13)18(20,21)22/h4-5,10-12H,3,6-9H2,1-2H3,(H2,26,27,30)/t11-/m0/s1
Affinity DataKi:  9.91nMAssay Description:Any of a number of standard assays for determining epoxide hydrolase activity can be used to determine inhibition of sEH. For example, suitable assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
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