Reaction Details Report a problem with these data
Target
Epoxide hydrolase 1
Ligand
BDBM129275
Substrate
n/a
Meas. Tech.
Activity Assay
IC50
50±n/a nM
Citation
 Hammock, BD; Zheng, J; Morisseau, C; Motoba, K; Moghaddam, MF; Borhan, B; Grant, DF; Greene, J; Sisemore, MF; Sanborn, J Inhibitors of epoxide hydrolases for the treatment of inflammation US Patent  US8815951 Publication Date 8/26/2014 
Target
Name:
Epoxide hydrolase 1
Synonyms:
Ephx1 | Epoxide hydrolase (HsEH) | Epoxide hydrolase (MsEH) | HYEP_MOUSE
Type:
Protein
Mol. Mass.:
52586.43
Organism:
Mus musculus (Mouse)
Description:
Q9D379
Residue:
455
Sequence:
MWLELILASVLGFVIYWFVSRDKEETLPLEDGWWGPGSKPSAKEDESIRPFKVETSDEEIKDLHQRIDRFRASPPLEGSRFHYGFNSSYLKKVVSFWRNEFDWRKQVEILNQYPHFKTKIEGLDIHFIHVKPPQLPSGRTPKPLLMVHGWPGSFYEFYKIIPLLTDPKTHGLSDEHVFEVICPSIPGYGFSEASSKKGLNSVATARIFYKLMSRLGFQKFYIQGGDWGSLICTNIAQMVPNHVKGLHLNMSFISRNIYSLTPLLGQRFGRFLGYTEKDLELLYPFKEKVFYNIMRESGYLHIQATKPDTVGCALNDSPVGLAAYILEKFSTWTKSEYRELEDGGLERKFSLEDLLTNIMIYWTTGTIVSSQRFYKENLGQGVMVHRHEGMKVFVPTGYSAFPSEILHAPEKWVKVKYPKLISYSYMERGGHFAAFEEPKLLAQDIRKFVSLAELQ
  
Inhibitor
Name:
BDBM129275
Synonyms:
US8815951, 428
Type:
Small organic molecule
Emp. Form.:
C17H32N2O
Mol. Mass.:
280.4488
SMILES:
CC(C)(C)C1CCC(CC1)NC(=O)NC1CCCCC1 |(5.66,3.05,;5.26,1.57,;6.35,.48,;6.75,1.96,;3.92,.8,;3.92,-.74,;2.59,-1.51,;1.26,-.74,;1.26,.8,;2.59,1.57,;-.08,-1.51,;-1.41,-.74,;-1.41,.8,;-2.74,-1.51,;-4.08,-.74,;-4.08,.8,;-5.41,1.57,;-6.75,.8,;-6.75,-.74,;-5.41,-1.51,)|
Structure:
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