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BDBM71510 US9546164, 530::US9694002, 529::US9694002, 530

SMILES: CC(C)(N1CCC[C@H](C1)Oc1cc(F)c(cc1C1CC1)C(N)=O)c1cccc(Cl)c1

InChI Key: InChIKey=WGJKXBIAQQOYRR-GOSISDBHSA-N

Data: 4 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 4 hits for monomerid = 71510   
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 Complex


(Homo sapiens (Human))
BDBM71510
PNG
(US9546164, 530 | US9694002, 529 | US9694002, 530)
Show SMILES CC(C)(N1CCC[C@H](C1)Oc1cc(F)c(cc1C1CC1)C(N)=O)c1cccc(Cl)c1 |r|
Show InChI InChI=1S/C24H28ClFN2O2/c1-24(2,16-5-3-6-17(25)11-16)28-10-4-7-18(14-28)30-22-13-21(26)20(23(27)29)12-19(22)15-8-9-15/h3,5-6,11-13,15,18H,4,7-10,14H2,1-2H3,(H2,27,29)/t18-/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
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antibodypedia
antibodypedia
antibodypedia
antibodypedia
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GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 2.40n/an/an/an/a7.425



GENENTECH, INC.; XENON PHARMACEUTICALS INC.

US Patent


Assay Description
Binding of this radioligand was preformed in 5 mL borosilicate glass test tubes at room temperature. Binding was initiated by adding membranes to inc...


US Patent US9694002 (2017)


BindingDB Entry DOI: 10.7270/Q24B2ZFG
More data for this
Ligand-Target Pair
Sodium channel protein type 5 subunit alpha


(Homo sapiens (Human))
BDBM71510
PNG
(US9546164, 530 | US9694002, 529 | US9694002, 530)
Show SMILES CC(C)(N1CCC[C@H](C1)Oc1cc(F)c(cc1C1CC1)C(N)=O)c1cccc(Cl)c1 |r|
Show InChI InChI=1S/C24H28ClFN2O2/c1-24(2,16-5-3-6-17(25)11-16)28-10-4-7-18(14-28)30-22-13-21(26)20(23(27)29)12-19(22)15-8-9-15/h3,5-6,11-13,15,18H,4,7-10,14H2,1-2H3,(H2,27,29)/t18-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 2.30n/an/an/an/a7.425



GENENTECH, INC.; XENON PHARMACEUTICALS INC.

US Patent


Assay Description
Radioligand Binding Studies: Saturation experiments. A representative compound of formula (I) having a methyl group was tritiated. Three tritiums wer...


US Patent US9546164 (2017)


BindingDB Entry DOI: 10.7270/Q2JD4ZS4
More data for this
Ligand-Target Pair
Sodium channel protein type 5 subunit alpha


(Homo sapiens (Human))
BDBM71510
PNG
(US9546164, 530 | US9694002, 529 | US9694002, 530)
Show SMILES CC(C)(N1CCC[C@H](C1)Oc1cc(F)c(cc1C1CC1)C(N)=O)c1cccc(Cl)c1 |r|
Show InChI InChI=1S/C24H28ClFN2O2/c1-24(2,16-5-3-6-17(25)11-16)28-10-4-7-18(14-28)30-22-13-21(26)20(23(27)29)12-19(22)15-8-9-15/h3,5-6,11-13,15,18H,4,7-10,14H2,1-2H3,(H2,27,29)/t18-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 2.40n/an/an/an/a7.425



GENENTECH, INC.; XENON PHARMACEUTICALS INC.

US Patent


Assay Description
Radioligand Binding Studies: Saturation experiments. A representative compound of formula (I) having a methyl group was tritiated. Three tritiums wer...


US Patent US9546164 (2017)


BindingDB Entry DOI: 10.7270/Q2JD4ZS4
More data for this
Ligand-Target Pair
Sodium Channel Complex


(Homo sapiens (Human))
BDBM71510
PNG
(US9546164, 530 | US9694002, 529 | US9694002, 530)
Show SMILES CC(C)(N1CCC[C@H](C1)Oc1cc(F)c(cc1C1CC1)C(N)=O)c1cccc(Cl)c1 |r|
Show InChI InChI=1S/C24H28ClFN2O2/c1-24(2,16-5-3-6-17(25)11-16)28-10-4-7-18(14-28)30-22-13-21(26)20(23(27)29)12-19(22)15-8-9-15/h3,5-6,11-13,15,18H,4,7-10,14H2,1-2H3,(H2,27,29)/t18-/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 2.30n/an/an/an/a7.425



GENENTECH, INC.; XENON PHARMACEUTICALS INC.

US Patent


Assay Description
Binding of this radioligand was preformed in 5 mL borosilicate glass test tubes at room temperature. Binding was initiated by adding membranes to inc...


US Patent US9694002 (2017)


BindingDB Entry DOI: 10.7270/Q24B2ZFG
More data for this
Ligand-Target Pair