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BDBM368284 US10227338, Example 67

SMILES: CN1CCN(CC1)c1cc(OC(F)(F)F)ccc1Nc1cc(F)c(cc1Cl)S(=O)(=O)Nc1cscn1

InChI Key: InChIKey=FNPORSLWKWJIJE-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 368284   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Sodium channel protein type 5 subunit alpha


(Homo sapiens (Human))
BDBM368284
PNG
(US10227338, Example 67)
Show SMILES CN1CCN(CC1)c1cc(OC(F)(F)F)ccc1Nc1cc(F)c(cc1Cl)S(=O)(=O)Nc1cscn1
Show InChI InChI=1S/C21H20ClF4N5O3S2/c1-30-4-6-31(7-5-30)18-8-13(34-21(24,25)26)2-3-16(18)28-17-10-15(23)19(9-14(17)22)36(32,33)29-20-11-35-12-27-20/h2-3,8-12,28-29H,4-7H2,1H3
PDB

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KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a>1.00E+4n/an/an/an/an/an/a



Daewoong Pharmaceutical Co., Ltd.

US Patent


Assay Description
In order to measure the sodium ion channel blocking effect, an IonFlux16 Auto patch clamp system (Fluxion, Inc.) and a plate for exclusive use were u...


US Patent US10227338 (2019)


BindingDB Entry DOI: 10.7270/Q2F47RFM
More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM368284
PNG
(US10227338, Example 67)
Show SMILES CN1CCN(CC1)c1cc(OC(F)(F)F)ccc1Nc1cc(F)c(cc1Cl)S(=O)(=O)Nc1cscn1
Show InChI InChI=1S/C21H20ClF4N5O3S2/c1-30-4-6-31(7-5-30)18-8-13(34-21(24,25)26)2-3-16(18)28-17-10-15(23)19(9-14(17)22)36(32,33)29-20-11-35-12-27-20/h2-3,8-12,28-29H,4-7H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 28n/an/an/an/an/an/a



Daewoong Pharmaceutical Co., Ltd.

US Patent


Assay Description
In order to measure the sodium ion channel blocking effect, an IonFlux16 Auto patch clamp system (Fluxion, Inc.) and a plate for exclusive use were u...


US Patent US10227338 (2019)


BindingDB Entry DOI: 10.7270/Q2F47RFM
More data for this
Ligand-Target Pair