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BDBM342765 N-Methyl-2-{4-[5-(2-trifluoromethoxy-benzylcarbamoyl)-thiophen-2-ylmethyl]-piperazin-1-yl}-nicotinamide::US9776991, Example 135

SMILES: CNC(=O)c1cccnc1N1CCN(Cc2ccc(s2)C(=O)NCc2ccccc2OC(F)(F)F)CC1

InChI Key: InChIKey=XTBNICZGKYZCTO-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 342765   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
EBifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM342765
PNG
(N-Methyl-2-{4-[5-(2-trifluoromethoxy-benzylcarbamo...)
Show SMILES CNC(=O)c1cccnc1N1CCN(Cc2ccc(s2)C(=O)NCc2ccccc2OC(F)(F)F)CC1
Show InChI InChI=1S/C25H26F3N5O3S/c1-29-23(34)19-6-4-10-30-22(19)33-13-11-32(12-14-33)16-18-8-9-21(37-18)24(35)31-15-17-5-2-3-7-20(17)36-25(26,27)28/h2-10H,11-16H2,1H3,(H,29,34)(H,31,35)
PDB

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KEGG

UniProtKB/SwissProt

antibodypedia
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PC cid
PC sid
UniChem
US Patent
n/an/a 2.14n/an/an/an/an/an/a



Sanofi

US Patent


Assay Description
Compounds were tested in a biochemical screening assay using recombinant sEH purified from Sf9 insect cells and an artificial substrate, (3-phenyl-ox...


US Patent US9776991 (2017)


BindingDB Entry DOI: 10.7270/Q2V126ZH
More data for this
Ligand-Target Pair