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BDBM181783 US9139593, 15

SMILES: Clc1ccccc1S(=O)(=O)N1C[C@]2(CC[C@@H]2C(=O)NCCCc2ccccc2)C1

InChI Key: InChIKey=OVYXEGNGUFYZOK-GOSISDBHSA-N

Data: 1 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 1 hit for monomerid = 181783   
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
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM181783
PNG
(US9139593, 15)
Show SMILES Clc1ccccc1S(=O)(=O)N1C[C@]2(CC[C@@H]2C(=O)NCCCc2ccccc2)C1 |r|
Show InChI InChI=1S/C22H25ClN2O3S/c23-19-10-4-5-11-20(19)29(27,28)25-15-22(16-25)13-12-18(22)21(26)24-14-6-9-17-7-2-1-3-8-17/h1-5,7-8,10-11,18H,6,9,12-16H2,(H,24,26)/t18-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 288n/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