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12 molecules are shown

Wt: 224.3
BDBM25731
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Wt: 252.3
BDBM41921
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Wt: 296.4
BDBM50124656
Wt: 254.4
BDBM50124658
Wt: 256.3
BDBM50124660
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Wt: 282.4
BDBM50143925
Wt: 214.2
BDBM50143930
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
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Wt: 238.3
BDBM50223393
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 39 hits for monomerid = 25731,41921,50124656,50124658,50124660,50143925,50143930,50143911,50143914,50192966,50192936,50223393   
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 B (EHB)


(Mycobacterium tuberculosis)
BDBM25731
PNG
(1,3-dicyclohexylurea | CHEMBL1458 | US8815951, 1,3...)
Show SMILES O=C(NC1CCCCC1)NC1CCCCC1
Show InChI InChI=1S/C13H24N2O/c16-13(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h11-12H,1-10H2,(H2,14,15,16)
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Article
PubMed
n/an/a 290n/an/an/an/a7.030



University of Alberta



Assay Description
Enzyme activity was measured by monitoring the appearance of fluorescent product, 6-methoxy-naphthaldehyde (ex@330 nm and em@ 465 nm) on a SpectraMax...


J Mol Biol 381: 897-912 (2008)


Article DOI: 10.1016/j.jmb.2008.06.030
BindingDB Entry DOI: 10.7270/Q2D50K94
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM25731
PNG
(1,3-dicyclohexylurea | CHEMBL1458 | US8815951, 1,3...)
Show SMILES O=C(NC1CCCCC1)NC1CCCCC1
Show InChI InChI=1S/C13H24N2O/c16-13(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h11-12H,1-10H2,(H2,14,15,16)
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n/an/a 52n/an/an/an/an/an/a



University of California-Davis

Curated by ChEMBL


Assay Description
Inhibition of human recombinant soluble epoxide hydrolase


J Med Chem 50: 3825-40 (2007)


Article DOI: 10.1021/jm070270t
BindingDB Entry DOI: 10.7270/Q2TQ62BW
More data for this
Ligand-Target Pair
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
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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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
Epoxide hydrolase (MsEH)


(Mus musculus (Mouse))
BDBM25731
PNG
(1,3-dicyclohexylurea | CHEMBL1458 | US8815951, 1,3...)
Show SMILES O=C(NC1CCCCC1)NC1CCCCC1
Show InChI InChI=1S/C13H24N2O/c16-13(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h11-12H,1-10H2,(H2,14,15,16)
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n/an/a 90n/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 (MsEH)


(Mus musculus (Mouse))
BDBM41921
PNG
(1-cyclohexyl-3-cyclooctyl-urea | 1-cyclohexyl-3-cy...)
Show SMILES O=C(NC1CCCCC1)NC1CCCCCCC1
Show InChI InChI=1S/C15H28N2O/c18-15(17-14-11-7-4-8-12-14)16-13-9-5-2-1-3-6-10-13/h13-14H,1-12H2,(H2,16,17,18)
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n/an/a 50n/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))
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 hydrolase 1


(Homo sapiens (Human))
BDBM25731
PNG
(1,3-dicyclohexylurea | CHEMBL1458 | US8815951, 1,3...)
Show SMILES O=C(NC1CCCCC1)NC1CCCCC1
Show InChI InChI=1S/C13H24N2O/c16-13(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h11-12H,1-10H2,(H2,14,15,16)
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n/an/a 160n/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))
BDBM41921
PNG
(1-cyclohexyl-3-cyclooctyl-urea | 1-cyclohexyl-3-cy...)
Show SMILES O=C(NC1CCCCC1)NC1CCCCCCC1
Show InChI InChI=1S/C15H28N2O/c18-15(17-14-11-7-4-8-12-14)16-13-9-5-2-1-3-6-10-13/h13-14H,1-12H2,(H2,16,17,18)
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n/an/a 90n/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))
BDBM25731
PNG
(1,3-dicyclohexylurea | CHEMBL1458 | US8815951, 1,3...)
Show SMILES O=C(NC1CCCCC1)NC1CCCCC1
Show InChI InChI=1S/C13H24N2O/c16-13(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h11-12H,1-10H2,(H2,14,15,16)
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PubMed
n/an/a 25n/an/an/an/an/an/a



Astellas Pharma Inc.

Curated by ChEMBL


Assay Description
Inhibition of human full-length C-terminal His6-tagged sEH expressed in Escherichia coli BL21(DE3) cells using PHOME as substrate incubated with enzy...


Bioorg Med Chem 22: 2427-34 (2014)


Article DOI: 10.1016/j.bmc.2014.03.001
BindingDB Entry DOI: 10.7270/Q2NV9KRF
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM25731
PNG
(1,3-dicyclohexylurea | CHEMBL1458 | US8815951, 1,3...)
Show SMILES O=C(NC1CCCCC1)NC1CCCCC1
Show InChI InChI=1S/C13H24N2O/c16-13(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h11-12H,1-10H2,(H2,14,15,16)
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n/an/a 5.10n/an/an/an/an/an/a



Volzhsky Polytechnic Institute (branch) Volgograd State Technical University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human soluble epoxide hydrolase using CMNPC as substrate preincubated for 5 mins followed by substrate addition measured at...


Bioorg Med Chem Lett 24: 2193-7 (2014)


Article DOI: 10.1016/j.bmcl.2014.03.016
BindingDB Entry DOI: 10.7270/Q2PR7XHZ
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM25731
PNG
(1,3-dicyclohexylurea | CHEMBL1458 | US8815951, 1,3...)
Show SMILES O=C(NC1CCCCC1)NC1CCCCC1
Show InChI InChI=1S/C13H24N2O/c16-13(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h11-12H,1-10H2,(H2,14,15,16)
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n/an/a 3n/an/an/an/an/an/a



Volzhsky Polytechnic Institute (branch) Volgograd State Technical University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human soluble epoxide hydrolase using CMNPC as substrate preincubated for 5 mins followed by substrate addition measured at...


Bioorg Med Chem Lett 24: 2193-7 (2014)


Article DOI: 10.1016/j.bmcl.2014.03.016
BindingDB Entry DOI: 10.7270/Q2PR7XHZ
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
Soluble epoxide hydrolase (sEH)


(Mus musculus (Mouse))
BDBM50124660
PNG
((3-Cyclohexyl-ureido)-acetic acid tert-butyl ester...)
Show SMILES CC(C)(C)OC(=O)CNC(=O)NC1CCCCC1
Show InChI InChI=1S/C13H24N2O3/c1-13(2,3)18-11(16)9-14-12(17)15-10-7-5-4-6-8-10/h10H,4-9H2,1-3H3,(H2,14,15,17)
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n/an/a 4.37E+3n/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))
BDBM50124660
PNG
((3-Cyclohexyl-ureido)-acetic acid tert-butyl ester...)
Show SMILES CC(C)(C)OC(=O)CNC(=O)NC1CCCCC1
Show InChI InChI=1S/C13H24N2O3/c1-13(2,3)18-11(16)9-14-12(17)15-10-7-5-4-6-8-10/h10H,4-9H2,1-3H3,(H2,14,15,17)
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n/an/a 1.91E+4n/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))
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))
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)
Soluble epoxide hydrolase (sEH)


(Mus musculus (Mouse))
BDBM50143930
PNG
((3-Cyclohexyl-ureido)-acetic acid methyl ester | C...)
Show SMILES COC(=O)CNC(=O)NC1CCCCC1
Show InChI InChI=1S/C10H18N2O3/c1-15-9(13)7-11-10(14)12-8-5-3-2-4-6-8/h8H,2-7H2,1H3,(H2,11,12,14)
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n/an/a 3.30E+4n/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))
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))
BDBM50143930
PNG
((3-Cyclohexyl-ureido)-acetic acid methyl ester | C...)
Show SMILES COC(=O)CNC(=O)NC1CCCCC1
Show InChI InChI=1S/C10H18N2O3/c1-15-9(13)7-11-10(14)12-8-5-3-2-4-6-8/h8H,2-7H2,1H3,(H2,11,12,14)
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n/an/a 7.00E+4n/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)
Epoxide hydratase


(Homo sapiens (Human))
BDBM50143930
PNG
((3-Cyclohexyl-ureido)-acetic acid methyl ester | C...)
Show SMILES COC(=O)CNC(=O)NC1CCCCC1
Show InChI InChI=1S/C10H18N2O3/c1-15-9(13)7-11-10(14)12-8-5-3-2-4-6-8/h8H,2-7H2,1H3,(H2,11,12,14)
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n/an/a 7.00E+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
Soluble epoxide hydrolase (sEH)


(Mus musculus (Mouse))
BDBM50143930
PNG
((3-Cyclohexyl-ureido)-acetic acid methyl ester | C...)
Show SMILES COC(=O)CNC(=O)NC1CCCCC1
Show InChI InChI=1S/C10H18N2O3/c1-15-9(13)7-11-10(14)12-8-5-3-2-4-6-8/h8H,2-7H2,1H3,(H2,11,12,14)
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n/an/a 3.30E+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
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))
BDBM50223393
PNG
(1-adamantan-1-yl-3-(2-hydroxyethyl)urea | CHEMBL39...)
Show SMILES OCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C13H22N2O2/c16-2-1-14-12(17)15-13-6-9-3-10(7-13)5-11(4-9)8-13/h9-11,16H,1-8H2,(H2,14,15,17)
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n/an/a 482n/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 fluorescent based assay


J Med Chem 50: 5217-26 (2007)


Article DOI: 10.1021/jm070705c
BindingDB Entry DOI: 10.7270/Q24T6J3C
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM25731
PNG
(1,3-dicyclohexylurea | CHEMBL1458 | US8815951, 1,3...)
Show SMILES O=C(NC1CCCCC1)NC1CCCCC1
Show InChI InChI=1S/C13H24N2O/c16-13(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h11-12H,1-10H2,(H2,14,15,16)
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n/an/a 25n/an/an/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Inhibition of sEH (unknown origin)


ACS Med Chem Lett 7: 341-4 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00099
BindingDB Entry DOI: 10.7270/Q2NG4SJJ
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM25731
PNG
(1,3-dicyclohexylurea | CHEMBL1458 | US8815951, 1,3...)
Show SMILES O=C(NC1CCCCC1)NC1CCCCC1
Show InChI InChI=1S/C13H24N2O/c16-13(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h11-12H,1-10H2,(H2,14,15,16)
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n/an/a 52n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human soluble epoxide hydrolase using CMNPC as substrate after 5 mins by fluorescent assay


Bioorg Med Chem Lett 22: 601-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.074
BindingDB Entry DOI: 10.7270/Q2TM7BJ7
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM41921
PNG
(1-cyclohexyl-3-cyclooctyl-urea | 1-cyclohexyl-3-cy...)
Show SMILES O=C(NC1CCCCC1)NC1CCCCCCC1
Show InChI InChI=1S/C15H28N2O/c18-15(17-14-11-7-4-8-12-14)16-13-9-5-2-1-3-6-10-13/h13-14H,1-12H2,(H2,16,17,18)
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n/an/a 11.7n/an/an/an/an/an/a



Columbia University Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Data Source: Columbia University Molecular Screening Center Source (MLSCN Center Name): Columbia University Molecular Screening Center Center Affilia...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2DZ06QW
More data for this
Ligand-Target Pair