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BDBM250926 US9452986, 230

SMILES: FC(F)(F)c1ccc(Oc2ccc3nc(ccc3c2)C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@@H]23)nc1

InChI Key: InChIKey=GAKMQJJNGCNNNN-BBVWWWHTSA-N

Data: 1 IC50

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 250926   
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))
BDBM250926
PNG
(US9452986, 230)
Show SMILES FC(F)(F)c1ccc(Oc2ccc3nc(ccc3c2)C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@@H]23)nc1
Show InChI InChI=1S/C30H27F3N4O2/c31-30(32,33)22-8-13-28(34-15-22)39-23-9-12-25-20(14-23)6-11-27(35-25)29(38)36-26-10-7-21-17-37(18-24(21)26)16-19-4-2-1-3-5-19/h1-6,8-9,11-15,21,24,26H,7,10,16-18H2,(H,36,38)/t21-,24+,26+/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 259n/an/an/an/an/a37



AbbVie Inc.

US Patent


Assay Description
Two days prior to the experiment, frozen HEK293 cells stably expressing recombinant human Nav1.7 were quickly thawed and plated at 25,000 cells/well ...


US Patent US9452986 (2016)


BindingDB Entry DOI: 10.7270/Q2MS3RQS
More data for this
Ligand-Target Pair