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BDBM145618 US8952169, 421

SMILES: CS(=O)(=O)NC(=O)c1cc(C2CC2)c(OCC2(CCCCC2)C(F)F)cc1F

InChI Key: InChIKey=QIORBNPHCMKQFW-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 145618   
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
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM145618
PNG
(US8952169, 421)
Show SMILES CS(=O)(=O)NC(=O)c1cc(C2CC2)c(OCC2(CCCCC2)C(F)F)cc1F
Show InChI InChI=1S/C19H24F3NO4S/c1-28(25,26)23-17(24)14-9-13(12-5-6-12)16(10-15(14)20)27-11-19(18(21)22)7-3-2-4-8-19/h9-10,12,18H,2-8,11H2,1H3,(H,23,24)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 32n/an/an/an/an/a37



Xenon Pharmaceuticals Inc.; Genentech, Inc.

US Patent


Assay Description
Patch voltage clamp electrophysiology allows for the direct measurement and quantification of block of voltage-gated sodium channels (NaV's), and all...


US Patent US8952169 (2015)


BindingDB Entry DOI: 10.7270/Q2M04445
More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM145618
PNG
(US8952169, 421)
Show SMILES CS(=O)(=O)NC(=O)c1cc(C2CC2)c(OCC2(CCCCC2)C(F)F)cc1F
Show InChI InChI=1S/C19H24F3NO4S/c1-28(25,26)23-17(24)14-9-13(12-5-6-12)16(10-15(14)20)27-11-19(18(21)22)7-3-2-4-8-19/h9-10,12,18H,2-8,11H2,1H3,(H,23,24)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 4n/an/an/an/a7.425



Xenon Pharmaceuticals Inc.; Genentech, Inc.

US Patent


Assay Description
Radioligand Binding Studies: Saturation experiments. A representative compound of formula (I) was tritiated. Three tritiums were incorporated in plac...


US Patent US8952169 (2015)


BindingDB Entry DOI: 10.7270/Q2M04445
More data for this
Ligand-Target Pair