BindingDB logo
myBDB logout

BDBM50295532 4-(3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidine-1-carboxamide::CHEMBL550242

SMILES: O=C(NC1CCc2ccccc2C1)N1CCC(CC1)c1nc(no1)-c1ccccn1

InChI Key: InChIKey=BYFSZZCFOSXKJG-UHFFFAOYSA-N

Data: 7 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 50295532   
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
EBifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50295532
PNG
(4-(3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl)-N-(1,2,3...)
Show SMILES O=C(NC1CCc2ccccc2C1)N1CCC(CC1)c1nc(no1)-c1ccccn1
Show InChI InChI=1S/C23H25N5O2/c29-23(25-19-9-8-16-5-1-2-6-18(16)15-19)28-13-10-17(11-14-28)22-26-21(27-30-22)20-7-3-4-12-24-20/h1-7,12,17,19H,8-11,13-15H2,(H,25,29)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 8n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of human sEH


J Med Chem 52: 5009-12 (2010)


Article DOI: 10.1021/jm900725r
BindingDB Entry DOI: 10.7270/Q2TX3G8W
More data for this
Ligand-Target Pair
Epoxide hydrolase 2


(Rattus norvegicus)
BDBM50295532
PNG
(4-(3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl)-N-(1,2,3...)
Show SMILES O=C(NC1CCc2ccccc2C1)N1CCC(CC1)c1nc(no1)-c1ccccn1
Show InChI InChI=1S/C23H25N5O2/c29-23(25-19-9-8-16-5-1-2-6-18(16)15-19)28-13-10-17(11-14-28)22-26-21(27-30-22)20-7-3-4-12-24-20/h1-7,12,17,19H,8-11,13-15H2,(H,25,29)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 22n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of rat sEH


J Med Chem 52: 5009-12 (2010)


Article DOI: 10.1021/jm900725r
BindingDB Entry DOI: 10.7270/Q2TX3G8W
More data for this
Ligand-Target Pair
EBifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50295532
PNG
(4-(3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl)-N-(1,2,3...)
Show SMILES O=C(NC1CCc2ccccc2C1)N1CCC(CC1)c1nc(no1)-c1ccccn1
Show InChI InChI=1S/C23H25N5O2/c29-23(25-19-9-8-16-5-1-2-6-18(16)15-19)28-13-10-17(11-14-28)22-26-21(27-30-22)20-7-3-4-12-24-20/h1-7,12,17,19H,8-11,13-15H2,(H,25,29)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 49n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of human sEH in HEK293 cells assessed as conversion of 14,15-epoxyeicosatrienoic acid to 14,15-dihydroepoxyeicosatrienoic acid


J Med Chem 52: 5009-12 (2010)


Article DOI: 10.1021/jm900725r
BindingDB Entry DOI: 10.7270/Q2TX3G8W
More data for this
Ligand-Target Pair
Sodium channel protein type 5 subunit alpha


(Homo sapiens (Human))
BDBM50295532
PNG
(4-(3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl)-N-(1,2,3...)
Show SMILES O=C(NC1CCc2ccccc2C1)N1CCC(CC1)c1nc(no1)-c1ccccn1
Show InChI InChI=1S/C23H25N5O2/c29-23(25-19-9-8-16-5-1-2-6-18(16)15-19)28-13-10-17(11-14-28)22-26-21(27-30-22)20-7-3-4-12-24-20/h1-7,12,17,19H,8-11,13-15H2,(H,25,29)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Nav1.5 channel


J Med Chem 52: 5009-12 (2010)


Article DOI: 10.1021/jm900725r
BindingDB Entry DOI: 10.7270/Q2TX3G8W
More data for this
Ligand-Target Pair
Calcium channel (Type L)


(Homo sapiens (Human))
BDBM50295532
PNG
(4-(3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl)-N-(1,2,3...)
Show SMILES O=C(NC1CCc2ccccc2C1)N1CCC(CC1)c1nc(no1)-c1ccccn1
Show InChI InChI=1S/C23H25N5O2/c29-23(25-19-9-8-16-5-1-2-6-18(16)15-19)28-13-10-17(11-14-28)22-26-21(27-30-22)20-7-3-4-12-24-20/h1-7,12,17,19H,8-11,13-15H2,(H,25,29)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>3.00E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Cav 1.2 channel


J Med Chem 52: 5009-12 (2010)


Article DOI: 10.1021/jm900725r
BindingDB Entry DOI: 10.7270/Q2TX3G8W
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50295532
PNG
(4-(3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl)-N-(1,2,3...)
Show SMILES O=C(NC1CCc2ccccc2C1)N1CCC(CC1)c1nc(no1)-c1ccccn1
Show InChI InChI=1S/C23H25N5O2/c29-23(25-19-9-8-16-5-1-2-6-18(16)15-19)28-13-10-17(11-14-28)22-26-21(27-30-22)20-7-3-4-12-24-20/h1-7,12,17,19H,8-11,13-15H2,(H,25,29)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a 6.00E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of IKr channel


J Med Chem 52: 5009-12 (2010)


Article DOI: 10.1021/jm900725r
BindingDB Entry DOI: 10.7270/Q2TX3G8W
More data for this
Ligand-Target Pair
Epoxide hydrolase 1


(Homo sapiens (Human))
BDBM50295532
PNG
(4-(3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl)-N-(1,2,3...)
Show SMILES O=C(NC1CCc2ccccc2C1)N1CCC(CC1)c1nc(no1)-c1ccccn1
Show InChI InChI=1S/C23H25N5O2/c29-23(25-19-9-8-16-5-1-2-6-18(16)15-19)28-13-10-17(11-14-28)22-26-21(27-30-22)20-7-3-4-12-24-20/h1-7,12,17,19H,8-11,13-15H2,(H,25,29)
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of human mEH


J Med Chem 52: 5009-12 (2010)


Article DOI: 10.1021/jm900725r
BindingDB Entry DOI: 10.7270/Q2TX3G8W
More data for this
Ligand-Target Pair