BindingDB logo
myBDB logout

24 similar compounds to monomer 50143919

Compile data set for download or QSAR
Wt: 450.6
BDBM50143927
Wt: 408.5
BDBM50143933
Wt: 436.5
BDBM50143938
Wt: 506.7
BDBM50143941
Wt: 394.5
BDBM50143942
Wt: 350.4
BDBM50143913
Wt: 298.4
BDBM50143916
Wt: 478.6
BDBM50143917
Wt: 380.4
BDBM50143923
Wt: 322.4
BDBM50192983
Wt: 434.6
BDBM50196649
Wt: 420.6
BDBM50196653
Wt: 434.6
BDBM50196654
Wt: 432.6
BDBM50196655
Wt: 526.7
BDBM50196656
Displayed 1 to 15 (of 24 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 37 hits for monomerid = 50143927,50143933,50143938,50143941,50143942,50143913,50143916,50143917,50143923,50192983,50196649,50196653,50196654,50196655,50196656   
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
Soluble epoxide hydrolase (sEH)


(Mus musculus (Mouse))
BDBM50143913
PNG
(4-(3-Adamantan-1-yl-ureido)-butyric acid pentyl es...)
Show SMILES CCCCCOC(=O)CCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C20H34N2O3/c1-2-3-4-8-25-18(23)6-5-7-21-19(24)22-20-12-15-9-16(13-20)11-17(10-15)14-20/h15-17H,2-14H2,1H3,(H2,21,22,24)
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
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
Epoxide hydratase


(Homo sapiens (Human))
BDBM50143913
PNG
(4-(3-Adamantan-1-yl-ureido)-butyric acid pentyl es...)
Show SMILES CCCCCOC(=O)CCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C20H34N2O3/c1-2-3-4-8-25-18(23)6-5-7-21-19(24)22-20-12-15-9-16(13-20)11-17(10-15)14-20/h15-17H,2-14H2,1H3,(H2,21,22,24)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 10n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibition of human soluble epoxide hydrolase pre-incubated for 5 mins at 30 degC before CMNPC fluorescent substrate addition by fluorimetric assay


Bioorg Med Chem Lett 22: 5889-92 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.074
BindingDB Entry DOI: 10.7270/Q2TH8NSF
More data for this
Ligand-Target Pair
Soluble epoxide hydrolase (sEH)


(Mus musculus (Mouse))
BDBM50143917
PNG
(10-[4-(3-Adamantan-1-yl-ureido)-butyryloxy]-decano...)
Show SMILES CCOC(=O)CCCCCCCCCOC(=O)CCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C27H46N2O5/c1-2-33-24(30)11-8-6-4-3-5-7-9-14-34-25(31)12-10-13-28-26(32)29-27-18-21-15-22(19-27)17-23(16-21)20-27/h21-23H,2-20H2,1H3,(H2,28,29,32)
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
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
Epoxide hydratase


(Homo sapiens (Human))
BDBM50143913
PNG
(4-(3-Adamantan-1-yl-ureido)-butyric acid pentyl es...)
Show SMILES CCCCCOC(=O)CCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C20H34N2O3/c1-2-3-4-8-25-18(23)6-5-7-21-19(24)22-20-12-15-9-16(13-20)11-17(10-15)14-20/h15-17H,2-14H2,1H3,(H2,21,22,24)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 170n/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))
BDBM50143916
PNG
(4-(3-Cyclohexyl-ureido)-butyric acid pentyl ester ...)
Show SMILES CCCCCOC(=O)CCCNC(=O)NC1CCCCC1
Show InChI InChI=1S/C16H30N2O3/c1-2-3-7-13-21-15(19)11-8-12-17-16(20)18-14-9-5-4-6-10-14/h14H,2-13H2,1H3,(H2,17,18,20)
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
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
Soluble epoxide hydrolase (sEH)


(Mus musculus (Mouse))
BDBM50143923
PNG
(4-(3-Adamantan-1-yl-ureido)-butyric acid 2-ethoxyc...)
Show SMILES CCOC(=O)CCOC(=O)CCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C20H32N2O5/c1-2-26-18(24)5-7-27-17(23)4-3-6-21-19(25)22-20-11-14-8-15(12-20)10-16(9-14)13-20/h14-16H,2-13H2,1H3,(H2,21,22,25)
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
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
Soluble epoxide hydrolase (sEH)


(Mus musculus (Mouse))
BDBM50143927
PNG
(8-[4-(3-Adamantan-1-yl-ureido)-butyryloxy]-octanoi...)
Show SMILES CCOC(=O)CCCCCCCOC(=O)CCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C25H42N2O5/c1-2-31-22(28)9-6-4-3-5-7-12-32-23(29)10-8-11-26-24(30)27-25-16-19-13-20(17-25)15-21(14-19)18-25/h19-21H,2-18H2,1H3,(H2,26,27,30)
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
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
Soluble epoxide hydrolase (sEH)


(Mus musculus (Mouse))
BDBM50143933
PNG
(5-[4-(3-Adamantan-1-yl-ureido)-butyryloxy]-pentano...)
Show SMILES CCOC(=O)CCCCOC(=O)CCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C22H36N2O5/c1-2-28-19(25)6-3-4-9-29-20(26)7-5-8-23-21(27)24-22-13-16-10-17(14-22)12-18(11-16)15-22/h16-18H,2-15H2,1H3,(H2,23,24,27)
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
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
Epoxide hydratase


(Homo sapiens (Human))
BDBM50143938
PNG
(7-[4-(3-Adamantan-1-yl-ureido)-butyryloxy]-heptano...)
Show SMILES CCOC(=O)CCCCCCOC(=O)CCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C24H40N2O5/c1-2-30-21(27)8-5-3-4-6-11-31-22(28)9-7-10-25-23(29)26-24-15-18-12-19(16-24)14-20(13-18)17-24/h18-20H,2-17H2,1H3,(H2,25,26,29)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 120n/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))
BDBM50143933
PNG
(5-[4-(3-Adamantan-1-yl-ureido)-butyryloxy]-pentano...)
Show SMILES CCOC(=O)CCCCOC(=O)CCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C22H36N2O5/c1-2-28-19(25)6-3-4-9-29-20(26)7-5-8-23-21(27)24-22-13-16-10-17(14-22)12-18(11-16)15-22/h16-18H,2-15H2,1H3,(H2,23,24,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 130n/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))
BDBM50143927
PNG
(8-[4-(3-Adamantan-1-yl-ureido)-butyryloxy]-octanoi...)
Show SMILES CCOC(=O)CCCCCCCOC(=O)CCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C25H42N2O5/c1-2-31-22(28)9-6-4-3-5-7-12-32-23(29)10-8-11-26-24(30)27-25-16-19-13-20(17-25)15-21(14-19)18-25/h19-21H,2-18H2,1H3,(H2,26,27,30)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 110n/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))
BDBM50143941
PNG
(12-[4-(3-Adamantan-1-yl-ureido)-butyryloxy]-dodeca...)
Show SMILES CCOC(=O)CCCCCCCCCCCOC(=O)CCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C29H50N2O5/c1-2-35-26(32)13-10-8-6-4-3-5-7-9-11-16-36-27(33)14-12-15-30-28(34)31-29-20-23-17-24(21-29)19-25(18-23)22-29/h23-25H,2-22H2,1H3,(H2,30,31,34)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 100n/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))
BDBM50143923
PNG
(4-(3-Adamantan-1-yl-ureido)-butyric acid 2-ethoxyc...)
Show SMILES CCOC(=O)CCOC(=O)CCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C20H32N2O5/c1-2-26-18(24)5-7-27-17(23)4-3-6-21-19(25)22-20-11-14-8-15(12-20)10-16(9-14)13-20/h14-16H,2-13H2,1H3,(H2,21,22,25)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 540n/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))
BDBM50143938
PNG
(7-[4-(3-Adamantan-1-yl-ureido)-butyryloxy]-heptano...)
Show SMILES CCOC(=O)CCCCCCOC(=O)CCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C24H40N2O5/c1-2-30-21(27)8-5-3-4-6-11-31-22(28)9-7-10-25-23(29)26-24-15-18-12-19(16-24)14-20(13-18)17-24/h18-20H,2-17H2,1H3,(H2,25,26,29)
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
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
Epoxide hydratase


(Homo sapiens (Human))
BDBM50143942
PNG
(4-(3-Adamantan-1-yl-ureido)-butyric acid 3-ethoxyc...)
Show SMILES CCOC(=O)CCCOC(=O)CCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C21H34N2O5/c1-2-27-18(24)6-4-8-28-19(25)5-3-7-22-20(26)23-21-12-15-9-16(13-21)11-17(10-15)14-21/h15-17H,2-14H2,1H3,(H2,22,23,26)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 120n/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))
BDBM50143917
PNG
(10-[4-(3-Adamantan-1-yl-ureido)-butyryloxy]-decano...)
Show SMILES CCOC(=O)CCCCCCCCCOC(=O)CCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C27H46N2O5/c1-2-33-24(30)11-8-6-4-3-5-7-9-14-34-25(31)12-10-13-28-26(32)29-27-18-21-15-22(19-27)17-23(16-21)20-27/h21-23H,2-20H2,1H3,(H2,28,29,32)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 100n/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))
BDBM50143941
PNG
(12-[4-(3-Adamantan-1-yl-ureido)-butyryloxy]-dodeca...)
Show SMILES CCOC(=O)CCCCCCCCCCCOC(=O)CCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C29H50N2O5/c1-2-35-26(32)13-10-8-6-4-3-5-7-9-11-16-36-27(33)14-12-15-30-28(34)31-29-20-23-17-24(21-29)19-25(18-23)22-29/h23-25H,2-22H2,1H3,(H2,30,31,34)
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
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
Soluble epoxide hydrolase (sEH)


(Mus musculus (Mouse))
BDBM50143942
PNG
(4-(3-Adamantan-1-yl-ureido)-butyric acid 3-ethoxyc...)
Show SMILES CCOC(=O)CCCOC(=O)CCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C21H34N2O5/c1-2-27-18(24)6-4-8-28-19(25)5-3-7-22-20(26)23-21-12-15-9-16(13-21)11-17(10-15)14-21/h15-17H,2-14H2,1H3,(H2,22,23,26)
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
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
Epoxide hydratase


(Homo sapiens (Human))
BDBM50143913
PNG
(4-(3-Adamantan-1-yl-ureido)-butyric acid pentyl es...)
Show SMILES CCCCCOC(=O)CCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C20H34N2O3/c1-2-3-4-8-25-18(23)6-5-7-21-19(24)22-20-12-15-9-16(13-20)11-17(10-15)14-20/h15-17H,2-14H2,1H3,(H2,21,22,24)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 170n/an/an/an/an/an/a



Department of Entomology and University of California Davis Cancer Center

Curated by ChEMBL


Assay Description
Inhibitory concentration against human soluble epoxide hydrolase (sEH) at 0.24 uM


J Med Chem 48: 3621-9 (2005)


Article DOI: 10.1021/jm0500929
BindingDB Entry DOI: 10.7270/Q2D799X0
More data for this
Ligand-Target Pair
Soluble epoxide hydrolase (sEH)


(Mus musculus (Mouse))
BDBM50143913
PNG
(4-(3-Adamantan-1-yl-ureido)-butyric acid pentyl es...)
Show SMILES CCCCCOC(=O)CCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C20H34N2O3/c1-2-3-4-8-25-18(23)6-5-7-21-19(24)22-20-12-15-9-16(13-20)11-17(10-15)14-20/h15-17H,2-14H2,1H3,(H2,21,22,24)
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
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
Inhibitory concentration against mouse soluble epoxide hydrolase (sEH) at 0.12 uM


J Med Chem 48: 3621-9 (2005)


Article DOI: 10.1021/jm0500929
BindingDB Entry DOI: 10.7270/Q2D799X0
More data for this
Ligand-Target Pair
Epoxide hydratase


(Homo sapiens (Human))
BDBM50192983
PNG
(6-(3-adamantan-1-yl-ureido)-hexanoic acid methyl e...)
Show SMILES COC(=O)CCCCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C18H30N2O3/c1-23-16(21)5-3-2-4-6-19-17(22)20-18-10-13-7-14(11-18)9-15(8-13)12-18/h13-15H,2-12H2,1H3,(H2,19,20,22)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.80E+3n/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
Epoxide hydratase


(Homo sapiens (Human))
BDBM50196649
PNG
(12-(3-adamantan-1-yl-ureido)-dodecanoic acid isopr...)
Show SMILES CC(C)OC(=O)CCCCCCCCCCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C26H46N2O3/c1-20(2)31-24(29)12-10-8-6-4-3-5-7-9-11-13-27-25(30)28-26-17-21-14-22(18-26)16-23(15-21)19-26/h20-23H,3-19H2,1-2H3,(H2,27,28,30)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.10n/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))
BDBM50196654
PNG
(12-(3-adamantan-1-yl-ureido)-dodecanoic acid propy...)
Show SMILES CCCOC(=O)CCCCCCCCCCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C26H46N2O3/c1-2-14-31-24(29)12-10-8-6-4-3-5-7-9-11-13-27-25(30)28-26-18-21-15-22(19-26)17-23(16-21)20-26/h21-23H,2-20H2,1H3,(H2,27,28,30)
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
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))
BDBM50196653
PNG
(12-(3-adamantan-1-yl-ureido)-dodecanoic acid ethyl...)
Show SMILES CCOC(=O)CCCCCCCCCCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C25H44N2O3/c1-2-30-23(28)12-10-8-6-4-3-5-7-9-11-13-26-24(29)27-25-17-20-14-21(18-25)16-22(15-20)19-25/h20-22H,2-19H2,1H3,(H2,26,27,29)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.60n/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))
BDBM50196655
PNG
(12-(3-adamantan-1-yl-ureido)-dodecanoic acid allyl...)
Show SMILES C=CCOC(=O)CCCCCCCCCCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C26H44N2O3/c1-2-14-31-24(29)12-10-8-6-4-3-5-7-9-11-13-27-25(30)28-26-18-21-15-22(19-26)17-23(16-21)20-26/h2,21-23H,1,3-20H2,(H2,27,28,30)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
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))
BDBM50196656
PNG
(12-(3-adamantan-1-yl-ureido)-dodecanoic acid adama...)
Show SMILES O=C(CCCCCCCCCCCNC(=O)NC12CC3CC(CC(C3)C1)C2)OC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C33H54N2O3/c36-30(38-33-21-27-15-28(22-33)17-29(16-27)23-33)10-8-6-4-2-1-3-5-7-9-11-34-31(37)35-32-18-24-12-25(19-32)14-26(13-24)20-32/h24-29H,1-23H2,(H2,34,35,37)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.5n/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))
BDBM50196653
PNG
(12-(3-adamantan-1-yl-ureido)-dodecanoic acid ethyl...)
Show SMILES CCOC(=O)CCCCCCCCCCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C25H44N2O3/c1-2-30-23(28)12-10-8-6-4-3-5-7-9-11-13-26-24(29)27-25-17-20-14-21(18-25)16-22(15-20)19-25/h20-22H,2-19H2,1H3,(H2,26,27,29)
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
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))
BDBM50196656
PNG
(12-(3-adamantan-1-yl-ureido)-dodecanoic acid adama...)
Show SMILES O=C(CCCCCCCCCCCNC(=O)NC12CC3CC(CC(C3)C1)C2)OC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C33H54N2O3/c36-30(38-33-21-27-15-28(22-33)17-29(16-27)23-33)10-8-6-4-2-1-3-5-7-9-11-34-31(37)35-32-18-24-12-25(19-32)14-26(13-24)20-32/h24-29H,1-23H2,(H2,34,35,37)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 230n/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))
BDBM50196656
PNG
(12-(3-adamantan-1-yl-ureido)-dodecanoic acid adama...)
Show SMILES O=C(CCCCCCCCCCCNC(=O)NC12CC3CC(CC(C3)C1)C2)OC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C33H54N2O3/c36-30(38-33-21-27-15-28(22-33)17-29(16-27)23-33)10-8-6-4-2-1-3-5-7-9-11-34-31(37)35-32-18-24-12-25(19-32)14-26(13-24)20-32/h24-29H,1-23H2,(H2,34,35,37)
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
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))
BDBM50196653
PNG
(12-(3-adamantan-1-yl-ureido)-dodecanoic acid ethyl...)
Show SMILES CCOC(=O)CCCCCCCCCCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C25H44N2O3/c1-2-30-23(28)12-10-8-6-4-3-5-7-9-11-13-26-24(29)27-25-17-20-14-21(18-25)16-22(15-20)19-25/h20-22H,2-19H2,1H3,(H2,26,27,29)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
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))
BDBM50196649
PNG
(12-(3-adamantan-1-yl-ureido)-dodecanoic acid isopr...)
Show SMILES CC(C)OC(=O)CCCCCCCCCCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C26H46N2O3/c1-20(2)31-24(29)12-10-8-6-4-3-5-7-9-11-13-27-25(30)28-26-17-21-14-22(18-26)16-23(15-21)19-26/h20-23H,3-19H2,1-2H3,(H2,27,28,30)
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
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))
BDBM50196649
PNG
(12-(3-adamantan-1-yl-ureido)-dodecanoic acid isopr...)
Show SMILES CC(C)OC(=O)CCCCCCCCCCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C26H46N2O3/c1-20(2)31-24(29)12-10-8-6-4-3-5-7-9-11-13-27-25(30)28-26-17-21-14-22(18-26)16-23(15-21)19-26/h20-23H,3-19H2,1-2H3,(H2,27,28,30)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
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))
BDBM50196654
PNG
(12-(3-adamantan-1-yl-ureido)-dodecanoic acid propy...)
Show SMILES CCCOC(=O)CCCCCCCCCCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C26H46N2O3/c1-2-14-31-24(29)12-10-8-6-4-3-5-7-9-11-13-27-25(30)28-26-18-21-15-22(19-26)17-23(16-21)20-26/h21-23H,2-20H2,1H3,(H2,27,28,30)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1n/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))
BDBM50196655
PNG
(12-(3-adamantan-1-yl-ureido)-dodecanoic acid allyl...)
Show SMILES C=CCOC(=O)CCCCCCCCCCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C26H44N2O3/c1-2-14-31-24(29)12-10-8-6-4-3-5-7-9-11-13-27-25(30)28-26-18-21-15-22(19-26)17-23(16-21)20-26/h2,21-23H,1,3-20H2,(H2,27,28,30)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1n/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))
BDBM50196655
PNG
(12-(3-adamantan-1-yl-ureido)-dodecanoic acid allyl...)
Show SMILES C=CCOC(=O)CCCCCCCCCCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C26H44N2O3/c1-2-14-31-24(29)12-10-8-6-4-3-5-7-9-11-13-27-25(30)28-26-18-21-15-22(19-26)17-23(16-21)20-26/h2,21-23H,1,3-20H2,(H2,27,28,30)
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
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))
BDBM50196654
PNG
(12-(3-adamantan-1-yl-ureido)-dodecanoic acid propy...)
Show SMILES CCCOC(=O)CCCCCCCCCCCNC(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C26H46N2O3/c1-2-14-31-24(29)12-10-8-6-4-3-5-7-9-11-13-27-25(30)28-26-18-21-15-22(19-26)17-23(16-21)20-26/h21-23H,2-20H2,1H3,(H2,27,28,30)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
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))
BDBM50143916
PNG
(4-(3-Cyclohexyl-ureido)-butyric acid pentyl ester ...)
Show SMILES CCCCCOC(=O)CCCNC(=O)NC1CCCCC1
Show InChI InChI=1S/C16H30N2O3/c1-2-3-7-13-21-15(19)11-8-12-17-16(20)18-14-9-5-4-6-10-14/h14H,2-13H2,1H3,(H2,17,18,20)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 1.02E+3n/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