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12 molecules are shown

Wt: 158.2
BDBM50124654
Purchase
Wt: 296.4
BDBM50124656
Wt: 254.4
BDBM50124658
Wt: 282.4
BDBM50143925
Wt: 214.2
BDBM50143908
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Wt: 200.2
BDBM50143911
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Wt: 200.2
BDBM50143914
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Wt: 256.3
BDBM50192966
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Wt: 228.2
BDBM50192936
Purchase
Wt: 419.6
BDBM50196665
Wt: 433.6
BDBM50196667
Wt: 281.3
BDBM50327823

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 33 hits for monomerid = 50124654,50124656,50124658,50143925,50143908,50143911,50143914,50192966,50192936,50196665,50196667,50327823   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Epoxide hydrolase (MsEH)


(Mus musculus (Mouse))
BDBM50143925
PNG
(1-Cyclohexyl-3-decyl-urea | CHEMBL67158 | N-CYCLOH...)
Show SMILES CCCCCCCCCCNC(=O)NC1CCCCC1
Show InChI InChI=1S/C17H34N2O/c1-2-3-4-5-6-7-8-12-15-18-17(20)19-16-13-10-9-11-14-16/h16H,2-15H2,1H3,(H2,18,19,20)
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n/an/a 60n/an/an/an/an/an/a



The Regents of the University of California

US Patent


Assay Description
The invention also provide methods for assaying for epoxide hydrolase activity as diagnostic assay to identify individuals at increased risk for hype...


US Patent US8815951 (2014)


BindingDB Entry DOI: 10.7270/Q2BP01G9
More data for this
Ligand-Target Pair
Soluble epoxide hydrolase (sEH)


(Mus musculus (Mouse))
BDBM50327823
PNG
(1-Cyclohexyl-3-(1-propionylpiperidin-4-yl)urea | C...)
Show SMILES CCC(=O)N1CCC(CC1)NC(=O)NC1CCCCC1
Show InChI InChI=1S/C15H27N3O2/c1-2-14(19)18-10-8-13(9-11-18)17-15(20)16-12-6-4-3-5-7-12/h12-13H,2-11H2,1H3,(H2,16,17,20)
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n/an/a 3.5n/an/an/an/an/an/a



Department of Entomology and University of California Davis Cancer Center

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant soluble epoxide hydrolase by fluorescence assay


J Med Chem 53: 7067-75 (2010)


Article DOI: 10.1021/jm100691c
BindingDB Entry DOI: 10.7270/Q2GH9J6V
More data for this
Ligand-Target Pair
Epoxide hydrolase 1


(Homo sapiens (Human))
BDBM50143925
PNG
(1-Cyclohexyl-3-decyl-urea | CHEMBL67158 | N-CYCLOH...)
Show SMILES CCCCCCCCCCNC(=O)NC1CCCCC1
Show InChI InChI=1S/C17H34N2O/c1-2-3-4-5-6-7-8-12-15-18-17(20)19-16-13-10-9-11-14-16/h16H,2-15H2,1H3,(H2,18,19,20)
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n/an/a 100n/an/an/an/an/an/a



The Regents of the University of California

US Patent


Assay Description
The invention also provide methods for assaying for epoxide hydrolase activity as diagnostic assay to identify individuals at increased risk for hype...


US Patent US8815951 (2014)


BindingDB Entry DOI: 10.7270/Q2BP01G9
More data for this
Ligand-Target Pair
Epoxide hydrolase 1


(Homo sapiens (Human))
BDBM50124658
PNG
(1-Cyclohexyl-3-(1,1,3,3-tetramethyl-butyl)-urea | ...)
Show SMILES CC(C)(C)CC(C)(C)NC(=O)NC1CCCCC1
Show InChI InChI=1S/C15H30N2O/c1-14(2,3)11-15(4,5)17-13(18)16-12-9-7-6-8-10-12/h12H,6-11H2,1-5H3,(H2,16,17,18)
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n/an/a 3.10E+3n/an/an/an/an/an/a



The Regents of the University of California

US Patent


Assay Description
The invention also provide methods for assaying for epoxide hydrolase activity as diagnostic assay to identify individuals at increased risk for hype...


US Patent US8815951 (2014)


BindingDB Entry DOI: 10.7270/Q2BP01G9
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50327823
PNG
(1-Cyclohexyl-3-(1-propionylpiperidin-4-yl)urea | C...)
Show SMILES CCC(=O)N1CCC(CC1)NC(=O)NC1CCCCC1
Show InChI InChI=1S/C15H27N3O2/c1-2-14(19)18-10-8-13(9-11-18)17-15(20)16-12-6-4-3-5-7-12/h12-13H,2-11H2,1H3,(H2,16,17,20)
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n/an/a 12n/an/an/an/a7.0n/a



The Regents of the University of California

US Patent


Assay Description
IC50 values were determined using a sensitive fluorescent based assay (Anal. Biochem. 2005, 343, 66-75). Cyano(2-methoxynaphthalen-6-yl)methyl trans-...


US Patent US9296693 (2016)


BindingDB Entry DOI: 10.7270/Q2TX3D7M
More data for this
Ligand-Target Pair
Soluble epoxide hydrolase (sEH)


(Mus musculus (Mouse))
BDBM50327823
PNG
(1-Cyclohexyl-3-(1-propionylpiperidin-4-yl)urea | C...)
Show SMILES CCC(=O)N1CCC(CC1)NC(=O)NC1CCCCC1
Show InChI InChI=1S/C15H27N3O2/c1-2-14(19)18-10-8-13(9-11-18)17-15(20)16-12-6-4-3-5-7-12/h12-13H,2-11H2,1H3,(H2,16,17,20)
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n/an/a 3.5n/an/an/an/a7.0n/a



The Regents of the University of California

US Patent


Assay Description
IC50 values were determined using a sensitive fluorescent based assay (Anal. Biochem. 2005, 343, 66-75). Cyano(2-methoxynaphthalen-6-yl)methyl trans-...


US Patent US9296693 (2016)


BindingDB Entry DOI: 10.7270/Q2TX3D7M
More data for this
Ligand-Target Pair
Soluble epoxide hydrolase (sEH)


(Mus musculus (Mouse))
BDBM50124654
PNG
(1-Hexyl-3-methyl-urea | CHEMBL11293)
Show SMILES CCCCCCNC(=O)NC
Show InChI InChI=1S/C8H18N2O/c1-3-4-5-6-7-10-8(11)9-2/h3-7H2,1-2H3,(H2,9,10,11)
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n/an/a 2.24E+5n/an/an/an/an/an/a



The Pennsylvania State University

Curated by ChEMBL


Assay Description
Inhibitory activity against murine soluble epoxide hydrolase


J Med Chem 46: 1066-80 (2003)


Article DOI: 10.1021/jm020269o
BindingDB Entry DOI: 10.7270/Q2GX49XM
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50124656
PNG
(1-Cyclopentyl-3-dodecyl-urea | CHEMBL11552)
Show SMILES CCCCCCCCCCCCNC(=O)NC1CCCC1
Show InChI InChI=1S/C18H36N2O/c1-2-3-4-5-6-7-8-9-10-13-16-19-18(21)20-17-14-11-12-15-17/h17H,2-16H2,1H3,(H2,19,20,21)
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n/an/a 550n/an/an/an/an/an/a



The Pennsylvania State University

Curated by ChEMBL


Assay Description
Inhibitory activity against human soluble epoxide hydrolase


J Med Chem 46: 1066-80 (2003)


Article DOI: 10.1021/jm020269o
BindingDB Entry DOI: 10.7270/Q2GX49XM
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50124658
PNG
(1-Cyclohexyl-3-(1,1,3,3-tetramethyl-butyl)-urea | ...)
Show SMILES CC(C)(C)CC(C)(C)NC(=O)NC1CCCCC1
Show InChI InChI=1S/C15H30N2O/c1-14(2,3)11-15(4,5)17-13(18)16-12-9-7-6-8-10-12/h12H,6-11H2,1-5H3,(H2,16,17,18)
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n/an/a 3.09E+3n/an/an/an/an/an/a



The Pennsylvania State University

Curated by ChEMBL


Assay Description
Inhibitory activity against human soluble epoxide hydrolase


J Med Chem 46: 1066-80 (2003)


Article DOI: 10.1021/jm020269o
BindingDB Entry DOI: 10.7270/Q2GX49XM
More data for this
Ligand-Target Pair
Soluble epoxide hydrolase (sEH)


(Mus musculus (Mouse))
BDBM50124658
PNG
(1-Cyclohexyl-3-(1,1,3,3-tetramethyl-butyl)-urea | ...)
Show SMILES CC(C)(C)CC(C)(C)NC(=O)NC1CCCCC1
Show InChI InChI=1S/C15H30N2O/c1-14(2,3)11-15(4,5)17-13(18)16-12-9-7-6-8-10-12/h12H,6-11H2,1-5H3,(H2,16,17,18)
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n/an/a 70.8n/an/an/an/an/an/a



The Pennsylvania State University

Curated by ChEMBL


Assay Description
Inhibitory activity against murine soluble epoxide hydrolase


J Med Chem 46: 1066-80 (2003)


Article DOI: 10.1021/jm020269o
BindingDB Entry DOI: 10.7270/Q2GX49XM
More data for this
Ligand-Target Pair
Soluble epoxide hydrolase (sEH)


(Mus musculus (Mouse))
BDBM50124656
PNG
(1-Cyclopentyl-3-dodecyl-urea | CHEMBL11552)
Show SMILES CCCCCCCCCCCCNC(=O)NC1CCCC1
Show InChI InChI=1S/C18H36N2O/c1-2-3-4-5-6-7-8-9-10-13-16-19-18(21)20-17-14-11-12-15-17/h17H,2-16H2,1H3,(H2,19,20,21)
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n/an/a 100n/an/an/an/an/an/a



The Pennsylvania State University

Curated by ChEMBL


Assay Description
Inhibitory activity against murine soluble epoxide hydrolase


J Med Chem 46: 1066-80 (2003)


Article DOI: 10.1021/jm020269o
BindingDB Entry DOI: 10.7270/Q2GX49XM
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50143908
PNG
(3-(3-Cyclohexyl-ureido)-propionic acid | CHEMBL304...)
Show SMILES OC(=O)CCNC(=O)NC1CCCCC1
Show InChI InChI=1S/C10H18N2O3/c13-9(14)6-7-11-10(15)12-8-4-2-1-3-5-8/h8H,1-7H2,(H,13,14)(H2,11,12,15)
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n/an/a 3.58E+5n/an/an/an/an/an/a



University of California-Davis

Curated by ChEMBL


Assay Description
Tested for 50 % inhibitory concentration against human soluble epoxide hydrolase (sEH)


J Med Chem 47: 2110-22 (2004)


Article DOI: 10.1021/jm030514j
BindingDB Entry DOI: 10.7270/Q29Z94BM
More data for this
Ligand-Target Pair
Soluble epoxide hydrolase (sEH)


(Mus musculus (Mouse))
BDBM50143911
PNG
(1-Cyclohexyl-3-(3-hydroxy-propyl)-urea | CHEMBL701...)
Show SMILES OCCCNC(=O)NC1CCCCC1
Show InChI InChI=1S/C10H20N2O2/c13-8-4-7-11-10(14)12-9-5-2-1-3-6-9/h9,13H,1-8H2,(H2,11,12,14)
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of California-Davis

Curated by ChEMBL


Assay Description
Tested for 50 % inhibitory concentration against mouse soluble epoxide hydrolase (sEH)


J Med Chem 47: 2110-22 (2004)


Article DOI: 10.1021/jm030514j
BindingDB Entry DOI: 10.7270/Q29Z94BM
More data for this
Ligand-Target Pair
Soluble epoxide hydrolase (sEH)


(Mus musculus (Mouse))
BDBM50143914
PNG
((3-Cyclohexyl-ureido)-acetic acid | 2-(3-cyclohexy...)
Show SMILES OC(=O)CNC(=O)NC1CCCCC1
Show InChI InChI=1S/C9H16N2O3/c12-8(13)6-10-9(14)11-7-4-2-1-3-5-7/h7H,1-6H2,(H,12,13)(H2,10,11,14)
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of California-Davis

Curated by ChEMBL


Assay Description
Tested for 50 % inhibitory concentration against mouse soluble epoxide hydrolase (sEH)


J Med Chem 47: 2110-22 (2004)


Article DOI: 10.1021/jm030514j
BindingDB Entry DOI: 10.7270/Q29Z94BM
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50143911
PNG
(1-Cyclohexyl-3-(3-hydroxy-propyl)-urea | CHEMBL701...)
Show SMILES OCCCNC(=O)NC1CCCCC1
Show InChI InChI=1S/C10H20N2O2/c13-8-4-7-11-10(14)12-9-5-2-1-3-6-9/h9,13H,1-8H2,(H2,11,12,14)
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of California-Davis

Curated by ChEMBL


Assay Description
Tested for 50 % inhibitory concentration against human soluble epoxide hydrolase (sEH)


J Med Chem 47: 2110-22 (2004)


Article DOI: 10.1021/jm030514j
BindingDB Entry DOI: 10.7270/Q29Z94BM
More data for this
Ligand-Target Pair
Soluble epoxide hydrolase (sEH)


(Mus musculus (Mouse))
BDBM50143908
PNG
(3-(3-Cyclohexyl-ureido)-propionic acid | CHEMBL304...)
Show SMILES OC(=O)CCNC(=O)NC1CCCCC1
Show InChI InChI=1S/C10H18N2O3/c13-9(14)6-7-11-10(15)12-8-4-2-1-3-5-8/h8H,1-7H2,(H,13,14)(H2,11,12,15)
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n/an/a 1.22E+5n/an/an/an/an/an/a



University of California-Davis

Curated by ChEMBL


Assay Description
Tested for 50 % inhibitory concentration against mouse soluble epoxide hydrolase (sEH)


J Med Chem 47: 2110-22 (2004)


Article DOI: 10.1021/jm030514j
BindingDB Entry DOI: 10.7270/Q29Z94BM
More data for this
Ligand-Target Pair
Soluble epoxide hydrolase (sEH)


(Mus musculus (Mouse))
BDBM50143925
PNG
(1-Cyclohexyl-3-decyl-urea | CHEMBL67158 | N-CYCLOH...)
Show SMILES CCCCCCCCCCNC(=O)NC1CCCCC1
Show InChI InChI=1S/C17H34N2O/c1-2-3-4-5-6-7-8-12-15-18-17(20)19-16-13-10-9-11-14-16/h16H,2-15H2,1H3,(H2,18,19,20)
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n/an/a 50n/an/an/an/an/an/a



University of California-Davis

Curated by ChEMBL


Assay Description
Tested for 50 % inhibitory concentration against mouse soluble epoxide hydrolase (sEH)


J Med Chem 47: 2110-22 (2004)


Article DOI: 10.1021/jm030514j
BindingDB Entry DOI: 10.7270/Q29Z94BM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Epoxide hydratase


(Homo sapiens (Human))
BDBM50143914
PNG
((3-Cyclohexyl-ureido)-acetic acid | 2-(3-cyclohexy...)
Show SMILES OC(=O)CNC(=O)NC1CCCCC1
Show InChI InChI=1S/C9H16N2O3/c12-8(13)6-10-9(14)11-7-4-2-1-3-5-7/h7H,1-6H2,(H,12,13)(H2,10,11,14)
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n/an/a>5.00E+5n/an/an/an/an/an/a



University of California-Davis

Curated by ChEMBL


Assay Description
Tested for 50 % inhibitory concentration against human soluble epoxide hydrolase (sEH)


J Med Chem 47: 2110-22 (2004)


Article DOI: 10.1021/jm030514j
BindingDB Entry DOI: 10.7270/Q29Z94BM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Epoxide hydratase


(Homo sapiens (Human))
BDBM50143925
PNG
(1-Cyclohexyl-3-decyl-urea | CHEMBL67158 | N-CYCLOH...)
Show SMILES CCCCCCCCCCNC(=O)NC1CCCCC1
Show InChI InChI=1S/C17H34N2O/c1-2-3-4-5-6-7-8-12-15-18-17(20)19-16-13-10-9-11-14-16/h16H,2-15H2,1H3,(H2,18,19,20)
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n/an/a 140n/an/an/an/an/an/a



University of California-Davis

Curated by ChEMBL


Assay Description
Tested for 50 % inhibitory concentration against human soluble epoxide hydrolase (sEH)


J Med Chem 47: 2110-22 (2004)


Article DOI: 10.1021/jm030514j
BindingDB Entry DOI: 10.7270/Q29Z94BM
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50192936
PNG
(4-(3-cyclohexylureido)butanoic acid | 4-{[(CYCLOHE...)
Show SMILES OC(=O)CCCNC(=O)NC1CCCCC1
Show InChI InChI=1S/C11H20N2O3/c14-10(15)7-4-8-12-11(16)13-9-5-2-1-3-6-9/h9H,1-8H2,(H,14,15)(H2,12,13,16)
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n/an/a 3.60E+4n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibition of human recombinant soluble Epoxide hydrolase


Bioorg Med Chem Lett 16: 5439-44 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.073
BindingDB Entry DOI: 10.7270/Q2183643
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Soluble epoxide hydrolase (sEH)


(Mus musculus (Mouse))
BDBM50192966
PNG
(6-(3-cyclohexylureido)hexanoic acid | 6-{[(CYCLOHE...)
Show SMILES OC(=O)CCCCCNC(=O)NC1CCCCC1
Show InChI InChI=1S/C13H24N2O3/c16-12(17)9-5-2-6-10-14-13(18)15-11-7-3-1-4-8-11/h11H,1-10H2,(H,16,17)(H2,14,15,18)
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n/an/a 2.40E+4n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant soluble Epoxide hydrolase


Bioorg Med Chem Lett 16: 5439-44 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.073
BindingDB Entry DOI: 10.7270/Q2183643
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50192966
PNG
(6-(3-cyclohexylureido)hexanoic acid | 6-{[(CYCLOHE...)
Show SMILES OC(=O)CCCCCNC(=O)NC1CCCCC1
Show InChI InChI=1S/C13H24N2O3/c16-12(17)9-5-2-6-10-14-13(18)15-11-7-3-1-4-8-11/h11H,1-10H2,(H,16,17)(H2,14,15,18)
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibition of human recombinant soluble Epoxide hydrolase


Bioorg Med Chem Lett 16: 5439-44 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.073
BindingDB Entry DOI: 10.7270/Q2183643
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Soluble epoxide hydrolase (sEH)


(Mus musculus (Mouse))
BDBM50143914
PNG
((3-Cyclohexyl-ureido)-acetic acid | 2-(3-cyclohexy...)
Show SMILES OC(=O)CNC(=O)NC1CCCCC1
Show InChI InChI=1S/C9H16N2O3/c12-8(13)6-10-9(14)11-7-4-2-1-3-5-7/h7H,1-6H2,(H,12,13)(H2,10,11,14)
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant soluble Epoxide hydrolase


Bioorg Med Chem Lett 16: 5439-44 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.073
BindingDB Entry DOI: 10.7270/Q2183643
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50143914
PNG
((3-Cyclohexyl-ureido)-acetic acid | 2-(3-cyclohexy...)
Show SMILES OC(=O)CNC(=O)NC1CCCCC1
Show InChI InChI=1S/C9H16N2O3/c12-8(13)6-10-9(14)11-7-4-2-1-3-5-7/h7H,1-6H2,(H,12,13)(H2,10,11,14)
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibition of human recombinant soluble Epoxide hydrolase


Bioorg Med Chem Lett 16: 5439-44 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.073
BindingDB Entry DOI: 10.7270/Q2183643
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Soluble epoxide hydrolase (sEH)


(Mus musculus (Mouse))
BDBM50192936
PNG
(4-(3-cyclohexylureido)butanoic acid | 4-{[(CYCLOHE...)
Show SMILES OC(=O)CCCNC(=O)NC1CCCCC1
Show InChI InChI=1S/C11H20N2O3/c14-10(15)7-4-8-12-11(16)13-9-5-2-1-3-6-9/h9H,1-8H2,(H,14,15)(H2,12,13,16)
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n/an/a 1.90E+3n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant soluble Epoxide hydrolase


Bioorg Med Chem Lett 16: 5439-44 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.073
BindingDB Entry DOI: 10.7270/Q2183643
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50196665
PNG
(12-(3-adamantan-1-yl-ureido)-dodecanoic acid ethyl...)
Show SMILES CCNC(=O)CCCCCCCCCCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C25H45N3O2/c1-2-26-23(29)12-10-8-6-4-3-5-7-9-11-13-27-24(30)28-25-17-20-14-21(18-25)16-22(15-20)19-25/h20-22H,2-19H2,1H3,(H,26,29)(H2,27,28,30)
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n/an/a 100n/an/an/an/an/an/a



Department of Entomology and University of California Davis Cancer Center

Curated by ChEMBL


Assay Description
Inhibition of human soluble epoxide hydrolase by spectrometric based assay


Bioorg Med Chem 15: 312-23 (2006)


Article DOI: 10.1016/j.bmc.2006.09.057
BindingDB Entry DOI: 10.7270/Q26D5SNJ
More data for this
Ligand-Target Pair
Soluble epoxide hydrolase (sEH)


(Mus musculus (Mouse))
BDBM50196665
PNG
(12-(3-adamantan-1-yl-ureido)-dodecanoic acid ethyl...)
Show SMILES CCNC(=O)CCCCCCCCCCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C25H45N3O2/c1-2-26-23(29)12-10-8-6-4-3-5-7-9-11-13-27-24(30)28-25-17-20-14-21(18-25)16-22(15-20)19-25/h20-22H,2-19H2,1H3,(H,26,29)(H2,27,28,30)
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n/an/a 50n/an/an/an/an/an/a



Department of Entomology and University of California Davis Cancer Center

Curated by ChEMBL


Assay Description
Inhibition of mouse soluble epoxide hydrolase by spectrometric based assay


Bioorg Med Chem 15: 312-23 (2006)


Article DOI: 10.1016/j.bmc.2006.09.057
BindingDB Entry DOI: 10.7270/Q26D5SNJ
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50196667
PNG
(12-(3-adamantan-1-yl-ureido)-dodecanoic acid isopr...)
Show SMILES CC(C)NC(=O)CCCCCCCCCCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C26H47N3O2/c1-20(2)28-24(30)12-10-8-6-4-3-5-7-9-11-13-27-25(31)29-26-17-21-14-22(18-26)16-23(15-21)19-26/h20-23H,3-19H2,1-2H3,(H,28,30)(H2,27,29,31)
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n/an/a 100n/an/an/an/an/an/a



Department of Entomology and University of California Davis Cancer Center

Curated by ChEMBL


Assay Description
Inhibition of human soluble epoxide hydrolase by spectrometric based assay


Bioorg Med Chem 15: 312-23 (2006)


Article DOI: 10.1016/j.bmc.2006.09.057
BindingDB Entry DOI: 10.7270/Q26D5SNJ
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50196665
PNG
(12-(3-adamantan-1-yl-ureido)-dodecanoic acid ethyl...)
Show SMILES CCNC(=O)CCCCCCCCCCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C25H45N3O2/c1-2-26-23(29)12-10-8-6-4-3-5-7-9-11-13-27-24(30)28-25-17-20-14-21(18-25)16-22(15-20)19-25/h20-22H,2-19H2,1H3,(H,26,29)(H2,27,28,30)
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n/an/a 4.30n/an/an/an/an/an/a



Department of Entomology and University of California Davis Cancer Center

Curated by ChEMBL


Assay Description
Inhibition of human soluble epoxide hydrolase by fluorescent based assay


Bioorg Med Chem 15: 312-23 (2006)


Article DOI: 10.1016/j.bmc.2006.09.057
BindingDB Entry DOI: 10.7270/Q26D5SNJ
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50196667
PNG
(12-(3-adamantan-1-yl-ureido)-dodecanoic acid isopr...)
Show SMILES CC(C)NC(=O)CCCCCCCCCCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C26H47N3O2/c1-20(2)28-24(30)12-10-8-6-4-3-5-7-9-11-13-27-25(31)29-26-17-21-14-22(18-26)16-23(15-21)19-26/h20-23H,3-19H2,1-2H3,(H,28,30)(H2,27,29,31)
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n/an/a 2.90n/an/an/an/an/an/a



Department of Entomology and University of California Davis Cancer Center

Curated by ChEMBL


Assay Description
Inhibition of human soluble epoxide hydrolase by fluorescent based assay


Bioorg Med Chem 15: 312-23 (2006)


Article DOI: 10.1016/j.bmc.2006.09.057
BindingDB Entry DOI: 10.7270/Q26D5SNJ
More data for this
Ligand-Target Pair
Soluble epoxide hydrolase (sEH)


(Mus musculus (Mouse))
BDBM50196667
PNG
(12-(3-adamantan-1-yl-ureido)-dodecanoic acid isopr...)
Show SMILES CC(C)NC(=O)CCCCCCCCCCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C26H47N3O2/c1-20(2)28-24(30)12-10-8-6-4-3-5-7-9-11-13-27-25(31)29-26-17-21-14-22(18-26)16-23(15-21)19-26/h20-23H,3-19H2,1-2H3,(H,28,30)(H2,27,29,31)
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n/an/a 50n/an/an/an/an/an/a



Department of Entomology and University of California Davis Cancer Center

Curated by ChEMBL


Assay Description
Inhibition of mouse soluble epoxide hydrolase by spectrometric based assay


Bioorg Med Chem 15: 312-23 (2006)


Article DOI: 10.1016/j.bmc.2006.09.057
BindingDB Entry DOI: 10.7270/Q26D5SNJ
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50327823
PNG
(1-Cyclohexyl-3-(1-propionylpiperidin-4-yl)urea | C...)
Show SMILES CCC(=O)N1CCC(CC1)NC(=O)NC1CCCCC1
Show InChI InChI=1S/C15H27N3O2/c1-2-14(19)18-10-8-13(9-11-18)17-15(20)16-12-6-4-3-5-7-12/h12-13H,2-11H2,1H3,(H2,16,17,20)
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n/an/a 12n/an/an/an/an/an/a



Department of Entomology and University of California Davis Cancer Center

Curated by ChEMBL


Assay Description
Inhibition of human recombinant soluble epoxide hydrolase by fluorescence assay


J Med Chem 53: 7067-75 (2010)


Article DOI: 10.1021/jm100691c
BindingDB Entry DOI: 10.7270/Q2GH9J6V
More data for this
Ligand-Target Pair
Epoxide hydrolase (MsEH)


(Mus musculus (Mouse))
BDBM50124658
PNG
(1-Cyclohexyl-3-(1,1,3,3-tetramethyl-butyl)-urea | ...)
Show SMILES CC(C)(C)CC(C)(C)NC(=O)NC1CCCCC1
Show InChI InChI=1S/C15H30N2O/c1-14(2,3)11-15(4,5)17-13(18)16-12-9-7-6-8-10-12/h12H,6-11H2,1-5H3,(H2,16,17,18)
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US Patent
n/an/a 70n/an/an/an/an/an/a



The Regents of the University of California

US Patent


Assay Description
The invention also provide methods for assaying for epoxide hydrolase activity as diagnostic assay to identify individuals at increased risk for hype...


US Patent US8815951 (2014)


BindingDB Entry DOI: 10.7270/Q2BP01G9
More data for this
Ligand-Target Pair