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BDBM181198 US9139529, 41

SMILES: COc1cc(F)ccc1Oc1nc2ccccc2nc1C(=O)Nc1nnn[nH]1

InChI Key: InChIKey=DAYWNRVVMMSBKX-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 181198   
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
Voltage-gated sodium channel subunit alpha Nav1.8


(Rattus norvegicus (Rat))
BDBM181198
PNG
(US9139529, 41)
Show SMILES COc1cc(F)ccc1Oc1nc2ccccc2nc1C(=O)Nc1nnn[nH]1
Show InChI InChI=1S/C17H12FN7O3/c1-27-13-8-9(18)6-7-12(13)28-16-14(15(26)21-17-22-24-25-23-17)19-10-4-2-3-5-11(10)20-16/h2-8H,1H3,(H2,21,22,23,24,25,26)
PDB

KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars

n/an/a 2.20E+3n/an/an/an/an/an/a



VERTEX PHARMACEUTICALS INCORPORATED

US Patent


Assay Description
Patch clamp electrophysiology was used to assess the efficacy and selectivity of sodium channel blockers in dorsal root ganglion neurons. Rat neurons...


US Patent US9139529 (2015)


BindingDB Entry DOI: 10.7270/Q2ZG6R1Z
More data for this
Ligand-Target Pair