BDBM50295546 CHEMBL551517::N-(2-phenylcyclopropyl)-4-(3-(pyrimidin-2-yl)-1,2,4-oxadiazol-5-yl)piperidine-1-carboxamide

SMILES O=C(NC1CC1c1ccccc1)N1CCC(CC1)c1nc(no1)-c1ncccn1

InChI Key InChIKey=DIYUAKHOKKCOEE-UHFFFAOYSA-N

Data  9 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 9 hits for monomerid = 50295546   

TargetBifunctional epoxide hydrolase 2(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50295546(N-(2-phenylcyclopropyl)-4-(3-(pyrimidin-2-yl)-1,2,...)
Affinity DataIC50: 33nMAssay Description:Inhibition of human sEHMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/24/2012
Entry Details Article
PubMed
TargetBifunctional epoxide hydrolase 2(Rat)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50295546(N-(2-phenylcyclopropyl)-4-(3-(pyrimidin-2-yl)-1,2,...)
Affinity DataIC50: 35nMAssay Description:Inhibition of rat sEHMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/24/2012
Entry Details Article
PubMed
TargetBifunctional epoxide hydrolase 2(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50295546(N-(2-phenylcyclopropyl)-4-(3-(pyrimidin-2-yl)-1,2,...)
Affinity DataIC50: 187nMAssay Description:Inhibition of human sEH in HEK293 cells assessed as conversion of 14,15-epoxyeicosatrienoic acid to 14,15-dihydroepoxyeicosatrienoic acidMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/24/2012
Entry Details Article
PubMed
TargetSodium channel protein type 5 subunit alpha(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50295546(N-(2-phenylcyclopropyl)-4-(3-(pyrimidin-2-yl)-1,2,...)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of Nav1.5 channelMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/24/2012
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50295546(N-(2-phenylcyclopropyl)-4-(3-(pyrimidin-2-yl)-1,2,...)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of CYP2D6More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/24/2012
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50295546(N-(2-phenylcyclopropyl)-4-(3-(pyrimidin-2-yl)-1,2,...)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/24/2012
Entry Details Article
PubMed
TargetVoltage-dependent L-type calcium channel subunit alpha-1C(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50295546(N-(2-phenylcyclopropyl)-4-(3-(pyrimidin-2-yl)-1,2,...)
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition of Cav 1.2 channelMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/24/2012
Entry Details Article
PubMed
TargetPotassium voltage-gated channel subfamily H member 2(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50295546(N-(2-phenylcyclopropyl)-4-(3-(pyrimidin-2-yl)-1,2,...)
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition of IKr channelMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/24/2012
Entry Details Article
PubMed
TargetEpoxide hydrolase 1(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50295546(N-(2-phenylcyclopropyl)-4-(3-(pyrimidin-2-yl)-1,2,...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of human mEHMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/24/2012
Entry Details Article
PubMed