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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Sodium channel protein type 9 subunit alpha' and Ligand = 'BDBM264714'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/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))
BDBM264714
PNG
((R)-1-(6-(4-(4-fluorophenoxy)phenyl)pyridin-2-yl)-...)
Show SMILES OC[C@@H](O)C(=O)c1cccc(n1)-c1ccc(Oc2ccc(F)cc2)cc1 |r|
Show InChI InChI=1S/C20H16FNO4/c21-14-6-10-16(11-7-14)26-15-8-4-13(5-9-15)17-2-1-3-18(22-17)20(25)19(24)12-23/h1-11,19,23-24H,12H2/t19-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 133n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human Nav1.7 expressed in HEK293 cells by FLIPR method


Bioorg Med Chem Lett 24: 3690-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.038
BindingDB Entry DOI: 10.7270/Q2KS6VJM
More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM264714
PNG
((R)-1-(6-(4-(4-fluorophenoxy)phenyl)pyridin-2-yl)-...)
Show SMILES OC[C@@H](O)C(=O)c1cccc(n1)-c1ccc(Oc2ccc(F)cc2)cc1 |r|
Show InChI InChI=1S/C20H16FNO4/c21-14-6-10-16(11-7-14)26-15-8-4-13(5-9-15)17-2-1-3-18(22-17)20(25)19(24)12-23/h1-11,19,23-24H,12H2/t19-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 133n/an/an/an/an/an/a



TBA

US Patent


Assay Description
In vitro assays were performed in a recombinant cell line expressing cDNA encoding the alpha subunit (Nav1.7, SCN9a, PN1, NE) of human Nav1.7 (Access...


US Patent US9718780 (2017)


BindingDB Entry DOI: 10.7270/Q29S1T13
More data for this
Ligand-Target Pair