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BDBM181778 US9139593, 10

SMILES: Clc1ccc(cc1)S(=O)(=O)N1CCC11CN(C1)C(=O)NC12CC3CC(CC(C3)C1)C2

InChI Key: InChIKey=XPEVXMOUUYWRJJ-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 181778   
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))
BDBM181778
PNG
(US9139593, 10)
Show SMILES Clc1ccc(cc1)S(=O)(=O)N1CCC11CN(C1)C(=O)NC12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C22H28ClN3O3S/c23-18-1-3-19(4-2-18)30(28,29)26-6-5-22(26)13-25(14-22)20(27)24-21-10-15-7-16(11-21)9-17(8-15)12-21/h1-4,15-17H,5-14H2,(H,24,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 2.55E+3n/an/an/an/a7.025



Hoffmann-La Roche Inc

US Patent


Assay Description
Test compounds (1.6 mM stock in DMSO) were diluted 3 fold in series in DMSO and 0.8 microliters per well were added into 384-well NBS microplates (Co...


US Patent US9139593 (2015)


BindingDB Entry DOI: 10.7270/Q2610Z3R
More data for this
Ligand-Target Pair