BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 316 hits with Last Name = 'rinderspacher' and Initial = 'a'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424629
PNG
(CHEMBL2313193)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(O)cc1
Show InChI InChI=1S/C20H24N2O4S/c1-14-3-8-19(15(2)13-14)27(25,26)22-11-9-16(10-12-22)20(24)21-17-4-6-18(23)7-5-17/h3-8,13,16,23H,9-12H2,1-2H3,(H,21,24)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 0.400n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424631
PNG
(CHEMBL2313191)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccccc1Br
Show InChI InChI=1S/C20H23BrN2O3S/c1-14-7-8-19(15(2)13-14)27(25,26)23-11-9-16(10-12-23)20(24)22-18-6-4-3-5-17(18)21/h3-8,13,16H,9-12H2,1-2H3,(H,22,24)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 0.600n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424594
PNG
(CHEMBL2313183)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc2cc(ccc2c1)C(O)=O
Show InChI InChI=1S/C25H26N2O5S/c1-16-3-8-23(17(2)13-16)33(31,32)27-11-9-18(10-12-27)24(28)26-22-7-6-19-14-21(25(29)30)5-4-20(19)15-22/h3-8,13-15,18H,9-12H2,1-2H3,(H,26,28)(H,29,30)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 0.600n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424632
PNG
(CHEMBL2313190)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccccc1F
Show InChI InChI=1S/C20H23FN2O3S/c1-14-7-8-19(15(2)13-14)27(25,26)23-11-9-16(10-12-23)20(24)22-18-6-4-3-5-17(18)21/h3-8,13,16H,9-12H2,1-2H3,(H,22,24)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.10n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424630
PNG
(CHEMBL2313192)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccccc1O
Show InChI InChI=1S/C20H24N2O4S/c1-14-7-8-19(15(2)13-14)27(25,26)22-11-9-16(10-12-22)20(24)21-17-5-3-4-6-18(17)23/h3-8,13,16,23H,9-12H2,1-2H3,(H,21,24)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.20n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424601
PNG
(CHEMBL2313176)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(cc1)S(=O)(=O)C(F)(F)F
Show InChI InChI=1S/C21H23F3N2O5S2/c1-14-3-8-19(15(2)13-14)33(30,31)26-11-9-16(10-12-26)20(27)25-17-4-6-18(7-5-17)32(28,29)21(22,23)24/h3-8,13,16H,9-12H2,1-2H3,(H,25,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.60n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424638
PNG
(CHEMBL2313189)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)NC12CC3CC(CC(C3)C1)C2 |TLB:29:20:27:23.24.25,19:20:27:23.24.25,THB:29:24:21.20.28:27,25:24:21:28.26.27,25:26:21:23.29.24|
Show InChI InChI=1S/C24H34N2O3S/c1-16-3-4-22(17(2)9-16)30(28,29)26-7-5-21(6-8-26)23(27)25-24-13-18-10-19(14-24)12-20(11-18)15-24/h3-4,9,18-21H,5-8,10-15H2,1-2H3,(H,25,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.70n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424596
PNG
(CHEMBL2313181)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1cnc2ccccc2c1
Show InChI InChI=1S/C23H25N3O3S/c1-16-7-8-22(17(2)13-16)30(28,29)26-11-9-18(10-12-26)23(27)25-20-14-19-5-3-4-6-21(19)24-15-20/h3-8,13-15,18H,9-12H2,1-2H3,(H,25,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.30n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424611
PNG
(CHEMBL2313166)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)NC1CCCCCCC1
Show InChI InChI=1S/C22H34N2O3S/c1-17-10-11-21(18(2)16-17)28(26,27)24-14-12-19(13-15-24)22(25)23-20-8-6-4-3-5-7-9-20/h10-11,16,19-20H,3-9,12-15H2,1-2H3,(H,23,25)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.80n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424615
PNG
(CHEMBL2313162)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)NC1CC1
Show InChI InChI=1S/C17H24N2O3S/c1-12-3-6-16(13(2)11-12)23(21,22)19-9-7-14(8-10-19)17(20)18-15-4-5-15/h3,6,11,14-15H,4-5,7-10H2,1-2H3,(H,18,20)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 4.60n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50191878
PNG
(1-(1-Acetyl-piperidin-4-ylmethyl)-3-adamantan-1-yl...)
Show SMILES CC(=O)N1CCC(CNC(=O)NC23CC4CC(CC(C4)C2)C3)CC1 |TLB:11:12:15.14.19:17,THB:13:14:17:21.12.20,13:12:15.14.19:17,20:12:15:19.18.17,20:18:15:21.13.12|
Show InChI InChI=1S/C19H31N3O2/c1-13(23)22-4-2-14(3-5-22)12-20-18(24)21-19-9-15-6-16(10-19)8-17(7-15)11-19/h14-17H,2-12H2,1H3,(H2,20,21,24)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 5n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of epoxide hydrolase (unknown origin)


Bioorg Med Chem Lett 19: 2354-9 (2009)


Article DOI: 10.1016/j.bmcl.2008.09.066
BindingDB Entry DOI: 10.7270/Q2J10322
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424635
PNG
(CHEMBL2313186)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)NC1CCCC1
Show InChI InChI=1S/C19H28N2O3S/c1-14-7-8-18(15(2)13-14)25(23,24)21-11-9-16(10-12-21)19(22)20-17-5-3-4-6-17/h7-8,13,16-17H,3-6,9-12H2,1-2H3,(H,20,22)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.20n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424616
PNG
(CHEMBL2313161)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc2OCOc2c1
Show InChI InChI=1S/C21H24N2O5S/c1-14-3-6-20(15(2)11-14)29(25,26)23-9-7-16(8-10-23)21(24)22-17-4-5-18-19(12-17)28-13-27-18/h3-6,11-12,16H,7-10,13H2,1-2H3,(H,22,24)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.20n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424637
PNG
(CHEMBL2313188)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)NCC1CCCCC1
Show InChI InChI=1S/C21H32N2O3S/c1-16-8-9-20(17(2)14-16)27(25,26)23-12-10-19(11-13-23)21(24)22-15-18-6-4-3-5-7-18/h8-9,14,18-19H,3-7,10-13,15H2,1-2H3,(H,22,24)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.80n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424619
PNG
(CHEMBL2313203)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1cccc2cccnc12
Show InChI InChI=1S/C23H25N3O3S/c1-16-8-9-21(17(2)15-16)30(28,29)26-13-10-19(11-14-26)23(27)25-20-7-3-5-18-6-4-12-24-22(18)20/h3-9,12,15,19H,10-11,13-14H2,1-2H3,(H,25,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424602
PNG
(CHEMBL2313175)
Show SMILES CC(C)c1ccc(NC(=O)C2CCN(CC2)S(=O)(=O)c2ccc(C)cc2C)cc1
Show InChI InChI=1S/C23H30N2O3S/c1-16(2)19-6-8-21(9-7-19)24-23(26)20-11-13-25(14-12-20)29(27,28)22-10-5-17(3)15-18(22)4/h5-10,15-16,20H,11-14H2,1-4H3,(H,24,26)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.70n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424610
PNG
(CHEMBL2313167)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C20H24N2O3S/c1-15-8-9-19(16(2)14-15)26(24,25)22-12-10-17(11-13-22)20(23)21-18-6-4-3-5-7-18/h3-9,14,17H,10-13H2,1-2H3,(H,21,23)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.90n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50278163
PNG
(CHEMBL469792 | N-cycloheptyl-1-(mesitylsulfonyl)pi...)
Show SMILES Cc1cc(C)c(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)NC1CCCCCC1
Show InChI InChI=1S/C22H34N2O3S/c1-16-14-17(2)21(18(3)15-16)28(26,27)24-12-10-19(11-13-24)22(25)23-20-8-6-4-5-7-9-20/h14-15,19-20H,4-13H2,1-3H3,(H,23,25)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
PDB
UniChem

Patents


Similars

PDB
Article
PubMed
n/an/a 7.90n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of epoxide hydrolase (unknown origin)


Bioorg Med Chem Lett 19: 2354-9 (2009)


Article DOI: 10.1016/j.bmcl.2008.09.066
BindingDB Entry DOI: 10.7270/Q2J10322
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424597
PNG
(CHEMBL2313180)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc2ccccc2c1
Show InChI InChI=1S/C24H26N2O3S/c1-17-7-10-23(18(2)15-17)30(28,29)26-13-11-20(12-14-26)24(27)25-22-9-8-19-5-3-4-6-21(19)16-22/h3-10,15-16,20H,11-14H2,1-2H3,(H,25,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 8.30n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424628
PNG
(CHEMBL2313194)
Show SMILES COC(=O)c1ccc(NC(=O)C2CCN(CC2)S(=O)(=O)c2ccc(C)cc2C)cc1
Show InChI InChI=1S/C22H26N2O5S/c1-15-4-9-20(16(2)14-15)30(27,28)24-12-10-17(11-13-24)21(25)23-19-7-5-18(6-8-19)22(26)29-3/h4-9,14,17H,10-13H2,1-3H3,(H,23,25)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 8.5n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424609
PNG
(CHEMBL2313168)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccccc1Cl
Show InChI InChI=1S/C20H23ClN2O3S/c1-14-7-8-19(15(2)13-14)27(25,26)23-11-9-16(10-12-23)20(24)22-18-6-4-3-5-17(18)21/h3-8,13,16H,9-12H2,1-2H3,(H,22,24)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 8.70n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50278131
PNG
(CHEMBL469579 | tert-butyl 4-(1-(mesitylsulfonyl)pi...)
Show SMILES Cc1cc(C)c(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)NC1CCN(CC1)C(=O)OC(C)(C)C
Show InChI InChI=1S/C25H39N3O5S/c1-17-15-18(2)22(19(3)16-17)34(31,32)28-13-7-20(8-14-28)23(29)26-21-9-11-27(12-10-21)24(30)33-25(4,5)6/h15-16,20-21H,7-14H2,1-6H3,(H,26,29)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 11n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of epoxide hydrolase (unknown origin)


Bioorg Med Chem Lett 19: 2354-9 (2009)


Article DOI: 10.1016/j.bmcl.2008.09.066
BindingDB Entry DOI: 10.7270/Q2J10322
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424604
PNG
(CHEMBL2313173)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C20H23N3O5S/c1-14-3-8-19(15(2)13-14)29(27,28)22-11-9-16(10-12-22)20(24)21-17-4-6-18(7-5-17)23(25)26/h3-8,13,16H,9-12H2,1-2H3,(H,21,24)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 12n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50278134
PNG
(CHEMBL469581 | N-(cyclohexylmethyl)-1-(mesitylsulf...)
Show SMILES Cc1cc(C)c(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)NCC1CCCCC1
Show InChI InChI=1S/C22H34N2O3S/c1-16-13-17(2)21(18(3)14-16)28(26,27)24-11-9-20(10-12-24)22(25)23-15-19-7-5-4-6-8-19/h13-14,19-20H,4-12,15H2,1-3H3,(H,23,25)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 12.6n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of epoxide hydrolase (unknown origin)


Bioorg Med Chem Lett 19: 2354-9 (2009)


Article DOI: 10.1016/j.bmcl.2008.09.066
BindingDB Entry DOI: 10.7270/Q2J10322
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50278187
PNG
(CHEMBL469998 | N-(2-chloro-6-fluorobenzyl)-1-(mesi...)
Show SMILES Cc1cc(C)c(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)NCc1c(F)cccc1Cl
Show InChI InChI=1S/C22H26ClFN2O3S/c1-14-11-15(2)21(16(3)12-14)30(28,29)26-9-7-17(8-10-26)22(27)25-13-18-19(23)5-4-6-20(18)24/h4-6,11-12,17H,7-10,13H2,1-3H3,(H,25,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 12.7n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of epoxide hydrolase (unknown origin)


Bioorg Med Chem Lett 19: 2354-9 (2009)


Article DOI: 10.1016/j.bmcl.2008.09.066
BindingDB Entry DOI: 10.7270/Q2J10322
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424618
PNG
(CHEMBL2313159)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc2ncccc2c1
Show InChI InChI=1S/C23H25N3O3S/c1-16-5-8-22(17(2)14-16)30(28,29)26-12-9-18(10-13-26)23(27)25-20-6-7-21-19(15-20)4-3-11-24-21/h3-8,11,14-15,18H,9-10,12-13H2,1-2H3,(H,25,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 13n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50278158
PNG
(CHEMBL472630 | N-cyclohexyl-1-(mesitylsulfonyl)pip...)
Show SMILES Cc1cc(C)c(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)NC1CCCCC1
Show InChI InChI=1S/C21H32N2O3S/c1-15-13-16(2)20(17(3)14-15)27(25,26)23-11-9-18(10-12-23)21(24)22-19-7-5-4-6-8-19/h13-14,18-19H,4-12H2,1-3H3,(H,22,24)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 16.4n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of epoxide hydrolase (unknown origin)


Bioorg Med Chem Lett 19: 2354-9 (2009)


Article DOI: 10.1016/j.bmcl.2008.09.066
BindingDB Entry DOI: 10.7270/Q2J10322
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424605
PNG
(CHEMBL2313172)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C21H24N2O5S/c1-14-3-8-19(15(2)13-14)29(27,28)23-11-9-16(10-12-23)20(24)22-18-6-4-17(5-7-18)21(25)26/h3-8,13,16H,9-12H2,1-2H3,(H,22,24)(H,25,26)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 17n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424633
PNG
(CHEMBL2313204)
Show SMILES CC(C)CNC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(C)cc1C
Show InChI InChI=1S/C18H28N2O3S/c1-13(2)12-19-18(21)16-7-9-20(10-8-16)24(22,23)17-6-5-14(3)11-15(17)4/h5-6,11,13,16H,7-10,12H2,1-4H3,(H,19,21)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 18n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50278145
PNG
(CHEMBL469546 | N-(2,4-dichlorobenzyl)-1-(mesitylsu...)
Show SMILES Cc1cc(C)c(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)NCc1ccc(Cl)cc1Cl
Show InChI InChI=1S/C22H26Cl2N2O3S/c1-14-10-15(2)21(16(3)11-14)30(28,29)26-8-6-17(7-9-26)22(27)25-13-18-4-5-19(23)12-20(18)24/h4-5,10-12,17H,6-9,13H2,1-3H3,(H,25,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 20n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of epoxide hydrolase (unknown origin)


Bioorg Med Chem Lett 19: 2354-9 (2009)


Article DOI: 10.1016/j.bmcl.2008.09.066
BindingDB Entry DOI: 10.7270/Q2J10322
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424626
PNG
(CHEMBL2313196)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(cc1)N1CCCCC1
Show InChI InChI=1S/C25H33N3O3S/c1-19-6-11-24(20(2)18-19)32(30,31)28-16-12-21(13-17-28)25(29)26-22-7-9-23(10-8-22)27-14-4-3-5-15-27/h6-11,18,21H,3-5,12-17H2,1-2H3,(H,26,29)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 20n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424606
PNG
(CHEMBL2313171)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1
Show InChI InChI=1S/C26H28N2O4S/c1-19-8-13-25(20(2)18-19)33(30,31)28-16-14-21(15-17-28)26(29)27-22-9-11-24(12-10-22)32-23-6-4-3-5-7-23/h3-13,18,21H,14-17H2,1-2H3,(H,27,29)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 20n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424608
PNG
(CHEMBL2313169)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccccc1C
Show InChI InChI=1S/C21H26N2O3S/c1-15-8-9-20(17(3)14-15)27(25,26)23-12-10-18(11-13-23)21(24)22-19-7-5-4-6-16(19)2/h4-9,14,18H,10-13H2,1-3H3,(H,22,24)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 20n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50278132
PNG
(1-(mesitylsulfonyl)-N-(1,2,3,4-tetrahydronaphthale...)
Show SMILES Cc1cc(C)c(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)NC1CCCc2ccccc12
Show InChI InChI=1S/C25H32N2O3S/c1-17-15-18(2)24(19(3)16-17)31(29,30)27-13-11-21(12-14-27)25(28)26-23-10-6-8-20-7-4-5-9-22(20)23/h4-5,7,9,15-16,21,23H,6,8,10-14H2,1-3H3,(H,26,28)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 20.1n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of epoxide hydrolase (unknown origin)


Bioorg Med Chem Lett 19: 2354-9 (2009)


Article DOI: 10.1016/j.bmcl.2008.09.066
BindingDB Entry DOI: 10.7270/Q2J10322
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424595
PNG
(CHEMBL2313182)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1cccc2cnccc12
Show InChI InChI=1S/C23H25N3O3S/c1-16-6-7-22(17(2)14-16)30(28,29)26-12-9-18(10-13-26)23(27)25-21-5-3-4-19-15-24-11-8-20(19)21/h3-8,11,14-15,18H,9-10,12-13H2,1-2H3,(H,25,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 23n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424627
PNG
(CHEMBL2313195)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C21H23F3N2O4S/c1-14-3-8-19(15(2)13-14)31(28,29)26-11-9-16(10-12-26)20(27)25-17-4-6-18(7-5-17)30-21(22,23)24/h3-8,13,16H,9-12H2,1-2H3,(H,25,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 23n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50278177
PNG
(CHEMBL470824 | N-(2,4-dichlorobenzyl)-1-(4-methoxy...)
Show SMILES COc1cc(C)c(c(C)c1C)S(=O)(=O)N1CCC(CC1)C(=O)NCc1ccc(Cl)cc1Cl
Show InChI InChI=1S/C23H28Cl2N2O4S/c1-14-11-21(31-4)15(2)16(3)22(14)32(29,30)27-9-7-17(8-10-27)23(28)26-13-18-5-6-19(24)12-20(18)25/h5-6,11-12,17H,7-10,13H2,1-4H3,(H,26,28)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 23.9n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of epoxide hydrolase (unknown origin)


Bioorg Med Chem Lett 19: 2354-9 (2009)


Article DOI: 10.1016/j.bmcl.2008.09.066
BindingDB Entry DOI: 10.7270/Q2J10322
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424621
PNG
(CHEMBL2313201)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1cc(Cl)cc(Cl)c1
Show InChI InChI=1S/C20H22Cl2N2O3S/c1-13-3-4-19(14(2)9-13)28(26,27)24-7-5-15(6-8-24)20(25)23-18-11-16(21)10-17(22)12-18/h3-4,9-12,15H,5-8H2,1-2H3,(H,23,25)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 25n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424607
PNG
(CHEMBL2313170)
Show SMILES COc1ccc(NC(=O)C2CCN(CC2)S(=O)(=O)c2ccc(C)cc2C)cc1
Show InChI InChI=1S/C21H26N2O4S/c1-15-4-9-20(16(2)14-15)28(25,26)23-12-10-17(11-13-23)21(24)22-18-5-7-19(27-3)8-6-18/h4-9,14,17H,10-13H2,1-3H3,(H,22,24)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 25n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50278152
PNG
(CHEMBL471241 | N-isopentyl-1-(mesitylsulfonyl)pipe...)
Show SMILES CC(C)CCNC(=O)C1CCN(CC1)S(=O)(=O)c1c(C)cc(C)cc1C
Show InChI InChI=1S/C20H32N2O3S/c1-14(2)6-9-21-20(23)18-7-10-22(11-8-18)26(24,25)19-16(4)12-15(3)13-17(19)5/h12-14,18H,6-11H2,1-5H3,(H,21,23)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 25.1n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of epoxide hydrolase (unknown origin)


Bioorg Med Chem Lett 19: 2354-9 (2009)


Article DOI: 10.1016/j.bmcl.2008.09.066
BindingDB Entry DOI: 10.7270/Q2J10322
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50278155
PNG
(CHEMBL470616 | N-(2-chlorobenzyl)-1-(mesitylsulfon...)
Show SMILES Cc1cc(C)c(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)NCc1ccccc1Cl
Show InChI InChI=1S/C22H27ClN2O3S/c1-15-12-16(2)21(17(3)13-15)29(27,28)25-10-8-18(9-11-25)22(26)24-14-19-6-4-5-7-20(19)23/h4-7,12-13,18H,8-11,14H2,1-3H3,(H,24,26)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 27.4n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of epoxide hydrolase (unknown origin)


Bioorg Med Chem Lett 19: 2354-9 (2009)


Article DOI: 10.1016/j.bmcl.2008.09.066
BindingDB Entry DOI: 10.7270/Q2J10322
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50278162
PNG
(CHEMBL469360 | N-(2-chloro-5-(trifluoromethyl)benz...)
Show SMILES Cc1cc(C)c(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)NCc1cc(ccc1Cl)C(F)(F)F
Show InChI InChI=1S/C23H26ClF3N2O3S/c1-14-10-15(2)21(16(3)11-14)33(31,32)29-8-6-17(7-9-29)22(30)28-13-18-12-19(23(25,26)27)4-5-20(18)24/h4-5,10-12,17H,6-9,13H2,1-3H3,(H,28,30)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 28.7n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of epoxide hydrolase (unknown origin)


Bioorg Med Chem Lett 19: 2354-9 (2009)


Article DOI: 10.1016/j.bmcl.2008.09.066
BindingDB Entry DOI: 10.7270/Q2J10322
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424614
PNG
(CHEMBL2313163)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)NC1CCC1
Show InChI InChI=1S/C18H26N2O3S/c1-13-6-7-17(14(2)12-13)24(22,23)20-10-8-15(9-11-20)18(21)19-16-4-3-5-16/h6-7,12,15-16H,3-5,8-11H2,1-2H3,(H,19,21)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 29n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50278185
PNG
(CHEMBL469572 | N-(1-(4-chlorophenyl)ethyl)-1-(mesi...)
Show SMILES CC(NC(=O)C1CCN(CC1)S(=O)(=O)c1c(C)cc(C)cc1C)c1ccc(Cl)cc1
Show InChI InChI=1S/C23H29ClN2O3S/c1-15-13-16(2)22(17(3)14-15)30(28,29)26-11-9-20(10-12-26)23(27)25-18(4)19-5-7-21(24)8-6-19/h5-8,13-14,18,20H,9-12H2,1-4H3,(H,25,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 29.1n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of epoxide hydrolase (unknown origin)


Bioorg Med Chem Lett 19: 2354-9 (2009)


Article DOI: 10.1016/j.bmcl.2008.09.066
BindingDB Entry DOI: 10.7270/Q2J10322
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50424624
PNG
(CHEMBL2313198)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C21H23F3N2O3S/c1-14-3-8-19(15(2)13-14)30(28,29)26-11-9-16(10-12-26)20(27)25-18-6-4-17(5-7-18)21(22,23)24/h3-8,13,16H,9-12H2,1-2H3,(H,25,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 30n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...


Bioorg Med Chem Lett 23: 417-21 (2012)


Article DOI: 10.1016/j.bmcl.2012.11.084
BindingDB Entry DOI: 10.7270/Q2Z60QBJ
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50278128
PNG
(CHEMBL469988 | N-(3,4-dichlorobenzyl)-1-(mesitylsu...)
Show SMILES Cc1cc(C)c(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)NCc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C22H26Cl2N2O3S/c1-14-10-15(2)21(16(3)11-14)30(28,29)26-8-6-18(7-9-26)22(27)25-13-17-4-5-19(23)20(24)12-17/h4-5,10-12,18H,6-9,13H2,1-3H3,(H,25,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 32n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of epoxide hydrolase (unknown origin)


Bioorg Med Chem Lett 19: 2354-9 (2009)


Article DOI: 10.1016/j.bmcl.2008.09.066
BindingDB Entry DOI: 10.7270/Q2J10322
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50278160
PNG
(CHEMBL469359 | N-(2,4-difluorobenzyl)-1-(mesitylsu...)
Show SMILES Cc1cc(C)c(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)NCc1ccc(F)cc1F
Show InChI InChI=1S/C22H26F2N2O3S/c1-14-10-15(2)21(16(3)11-14)30(28,29)26-8-6-17(7-9-26)22(27)25-13-18-4-5-19(23)12-20(18)24/h4-5,10-12,17H,6-9,13H2,1-3H3,(H,25,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 32.2n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of epoxide hydrolase (unknown origin)


Bioorg Med Chem Lett 19: 2354-9 (2009)


Article DOI: 10.1016/j.bmcl.2008.09.066
BindingDB Entry DOI: 10.7270/Q2J10322
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50278165
PNG
(CHEMBL512872 | N'-(2-chlorophenyl)-1-(mesitylsulfo...)
Show SMILES Cc1cc(C)c(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)NNc1ccccc1Cl
Show InChI InChI=1S/C21H26ClN3O3S/c1-14-12-15(2)20(16(3)13-14)29(27,28)25-10-8-17(9-11-25)21(26)24-23-19-7-5-4-6-18(19)22/h4-7,12-13,17,23H,8-11H2,1-3H3,(H,24,26)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 33.6n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of epoxide hydrolase (unknown origin)


Bioorg Med Chem Lett 19: 2354-9 (2009)


Article DOI: 10.1016/j.bmcl.2008.09.066
BindingDB Entry DOI: 10.7270/Q2J10322
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50278181
PNG
(CHEMBL512704 | N-(3,3-diphenylpropyl)-1-(mesitylsu...)
Show SMILES Cc1cc(C)c(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)NCCC(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C30H36N2O3S/c1-22-20-23(2)29(24(3)21-22)36(34,35)32-18-15-27(16-19-32)30(33)31-17-14-28(25-10-6-4-7-11-25)26-12-8-5-9-13-26/h4-13,20-21,27-28H,14-19H2,1-3H3,(H,31,33)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 35n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of epoxide hydrolase (unknown origin)


Bioorg Med Chem Lett 19: 2354-9 (2009)


Article DOI: 10.1016/j.bmcl.2008.09.066
BindingDB Entry DOI: 10.7270/Q2J10322
More data for this
Ligand-Target Pair
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50278129
PNG
(1-(mesitylsulfonyl)-N-(2-methylcyclohexyl)piperidi...)
Show SMILES CC1CCCCC1NC(=O)C1CCN(CC1)S(=O)(=O)c1c(C)cc(C)cc1C
Show InChI InChI=1S/C22H34N2O3S/c1-15-13-17(3)21(18(4)14-15)28(26,27)24-11-9-19(10-12-24)22(25)23-20-8-6-5-7-16(20)2/h13-14,16,19-20H,5-12H2,1-4H3,(H,23,25)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 37.2n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of epoxide hydrolase (unknown origin)


Bioorg Med Chem Lett 19: 2354-9 (2009)


Article DOI: 10.1016/j.bmcl.2008.09.066
BindingDB Entry DOI: 10.7270/Q2J10322
More data for this
Ligand-Target Pair
Displayed 1 to 50 (of 316 total )  |  Next  |  Last  >>
Jump to: