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Compile Data Set for Download or QSAR

Found 431 hits Enz. Inhib. hit(s) with all data for entry = 1516   
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
nav 1.7 px


(Homo sapiens (Human))
BDBM329283
PNG
(4-(5-chloro-6-(3,5-dichlorophenoxy)-3-pyridinyl)-5...)
Show SMILES NC(=O)c1cc(OC(F)F)c(cc1S(=O)(=O)CF)-c1cnc(Oc2cc(Cl)cc(Cl)c2)c(Cl)c1
Show InChI InChI=1S/C20H12Cl3F3N2O5S/c21-10-2-11(22)4-12(3-10)32-19-15(23)1-9(7-28-19)13-6-17(34(30,31)8-24)14(18(27)29)5-16(13)33-20(25)26/h1-7,20H,8H2,(H2,27,29)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 14n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329279
PNG
(4-(5-chloro-6-(2,4-dichloro-6-methylphenoxy)-3-pyr...)
Show SMILES Cc1cc(Cl)cc(Cl)c1Oc1ncc(cc1Cl)-c1cc(F)c(cc1OC(F)F)C(=O)NS(C)(=O)=O
Show InChI InChI=1S/C21H14Cl3F3N2O5S/c1-9-3-11(22)5-14(23)18(9)34-20-15(24)4-10(8-28-20)12-6-16(25)13(7-17(12)33-21(26)27)19(30)29-35(2,31)32/h3-8,21H,1-2H3,(H,29,30)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 16.1n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329192
PNG
(4-(5-cyano-6-(3,6-dichloro-2-methylphenoxy)-3-pyri...)
Show SMILES COc1cc(ccc1-c1cnc(Oc2c(Cl)ccc(Cl)c2C)c(c1)C#N)C(=O)NS(C)(=O)=O
Show InChI InChI=1S/C22H17Cl2N3O5S/c1-12-17(23)6-7-18(24)20(12)32-22-14(10-25)8-15(11-26-22)16-5-4-13(9-19(16)31-2)21(28)27-33(3,29)30/h4-9,11H,1-3H3,(H,27,28)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 17.2n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329097
PNG
(5-chloro-4-(5-chloro-6-(2,4-dichloro-6-methylpheno...)
Show SMILES Cc1cc(Cl)cc(Cl)c1Oc1ncc(cc1Cl)-c1cc(F)c(cc1Cl)C(=O)NS(C)(=O)=O
Show InChI InChI=1S/C20H13Cl4FN2O4S/c1-9-3-11(21)5-15(23)18(9)31-20-16(24)4-10(8-26-20)12-7-17(25)13(6-14(12)22)19(28)27-32(2,29)30/h3-8H,1-2H3,(H,27,28)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 18.4n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329191
PNG
(4-(5-cyano-6-(2,6-dichloro-4- methylphenoxy)-3-pyr...)
Show SMILES COc1cc(ccc1-c1cnc(Oc2c(Cl)cc(C)cc2Cl)c(c1)C#N)C(=O)NS(C)(=O)=O
Show InChI InChI=1S/C22H17Cl2N3O5S/c1-12-6-17(23)20(18(24)7-12)32-22-14(10-25)8-15(11-26-22)16-5-4-13(9-19(16)31-2)21(28)27-33(3,29)30/h4-9,11H,1-3H3,(H,27,28)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 22.1n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329298
PNG
(4-(5-chloro-6-(2,4-dichloro-6- methylphenoxy)-3-py...)
Show SMILES Cc1cc(Cl)cc(Cl)c1Oc1ncc(cc1Cl)-c1cc(F)c(cc1C)C(=O)NS(=O)(=O)c1nccs1
Show InChI InChI=1S/C23H15Cl3FN3O4S2/c1-11-6-16(21(31)30-36(32,33)23-28-3-4-35-23)19(27)9-15(11)13-7-18(26)22(29-10-13)34-20-12(2)5-14(24)8-17(20)25/h3-10H,1-2H3,(H,30,31)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 23.1n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329287
PNG
(4-(5-chloro-6-(2,4-dichloro-6- methylphenoxy)-3-py...)
Show SMILES CCS(=O)(=O)NC(=O)c1ccc(c(OC)c1)-c1cnc(Oc2c(C)cc(Cl)cc2Cl)c(Cl)c1
Show InChI InChI=1S/C22H19Cl3N2O5S/c1-4-33(29,30)27-21(28)13-5-6-16(19(9-13)31-3)14-8-18(25)22(26-11-14)32-20-12(2)7-15(23)10-17(20)24/h5-11H,4H2,1-3H3,(H,27,28)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 24.8n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329293
PNG
(3-bromo-4-(5-chloro-6-(2,4- dichloro-6-methylpheno...)
Show SMILES Cc1cc(Cl)cc(Cl)c1Oc1ncc(cc1Cl)-c1ccc(cc1Br)C(=O)NS(C)(=O)=O
Show InChI InChI=1S/C20H14BrCl3N2O4S/c1-10-5-13(22)8-16(23)18(10)30-20-17(24)7-12(9-25-20)14-4-3-11(6-15(14)21)19(27)26-31(2,28)29/h3-9H,1-2H3,(H,26,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 27.5n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329187
PNG
(4-(5-cyano-6-(2,4-dichloro-6- methylphenoxy)-3-pyr...)
Show SMILES COc1cc(ccc1-c1cnc(Oc2c(C)cc(Cl)cc2Cl)c(c1)C#N)C(=O)NS(C)(=O)=O
Show InChI InChI=1S/C22H17Cl2N3O5S/c1-12-6-16(23)9-18(24)20(12)32-22-14(10-25)7-15(11-26-22)17-5-4-13(8-19(17)31-2)21(28)27-33(3,29)30/h4-9,11H,1-3H3,(H,27,28)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 28.4n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329077
PNG
(4-(5-Chloro-6-(2,4-Dichloro-6-Methylphenoxy)-Pyrid...)
Show SMILES COc1cc(ccc1-c1cnc(Oc2c(C)cc(Cl)cc2Cl)c(Cl)c1)C(=O)NS(C)(=O)=O
Show InChI InChI=1S/C21H17Cl3N2O5S/c1-11-6-14(22)9-16(23)19(11)31-21-17(24)7-13(10-25-21)15-5-4-12(8-18(15)30-2)20(27)26-32(3,28)29/h4-10H,1-3H3,(H,26,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 29.6n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329082
PNG
(4-(5-Chloro-6-(2,3-Dichlorophenoxy)Pyridin-3-yl)-3...)
Show SMILES COc1cc(ccc1-c1cnc(Oc2cccc(Cl)c2Cl)c(Cl)c1)C(=O)NS(C)(=O)=O
Show InChI InChI=1S/C20H15Cl3N2O5S/c1-29-17-9-11(19(26)25-31(2,27)28)6-7-13(17)12-8-15(22)20(24-10-12)30-16-5-3-4-14(21)18(16)23/h3-10H,1-2H3,(H,25,26)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 30.5n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329039
PNG
(4-(5-chloro-6-(3,5- dichlorophenoxy)-3-pyridinyl)-...)
Show SMILES CS(=O)(=O)NC(=O)c1ccc(c(OC2COC2)c1)-c1cnc(Oc2cc(Cl)cc(Cl)c2)c(Cl)c1
Show InChI InChI=1S/C22H17Cl3N2O6S/c1-34(29,30)27-21(28)12-2-3-18(20(5-12)32-17-10-31-11-17)13-4-19(25)22(26-9-13)33-16-7-14(23)6-15(24)8-16/h2-9,17H,10-11H2,1H3,(H,27,28)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 31.3n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329042
PNG
(4-(5-chloro-6-(3-chloro-4- methylphenoxy)-3-pyridi...)
Show SMILES Cc1ccc(Oc2ncc(cc2Cl)-c2ccc(cc2OC2COC2)C(=O)NS(C)(=O)=O)cc1Cl
Show InChI InChI=1S/C23H20Cl2N2O6S/c1-13-3-5-16(9-19(13)24)33-23-20(25)7-15(10-26-23)18-6-4-14(22(28)27-34(2,29)30)8-21(18)32-17-11-31-12-17/h3-10,17H,11-12H2,1-2H3,(H,27,28)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 32.2n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329206
PNG
(4-(5-chloro-6-(2-chloro-3,5- difluorophenoxy)-3-py...)
Show SMILES COc1cc(C(=O)NS(C)(=O)=O)c(F)cc1-c1cnc(OCc2nc3ccccc3s2)c(Cl)c1
Show InChI InChI=1S/C22H17ClFN3O5S2/c1-31-18-9-14(21(28)27-34(2,29)30)16(24)8-13(18)12-7-15(23)22(25-10-12)32-11-20-26-17-5-3-4-6-19(17)33-20/h3-10H,11H2,1-2H3,(H,27,28)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 32.6n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329054
PNG
(4-(5-chloro-6-(3,5- dichlorophenoxy)-3-pyridinyl)-...)
Show SMILES CS(=O)(=O)NC(=O)c1ccc(c(OC(F)F)c1)-c1cnc(Oc2cc(Cl)cc(Cl)c2)c(Cl)c1
Show InChI InChI=1S/C20H13Cl3F2N2O5S/c1-33(29,30)27-18(28)10-2-3-15(17(5-10)32-20(24)25)11-4-16(23)19(26-9-11)31-14-7-12(21)6-13(22)8-14/h2-9,20H,1H3,(H,27,28)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 33.7n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329015
PNG
(4-(5-chloro-6-(3,5- dichlorophenoxy)-3-pyridinyl)-...)
Show SMILES COc1cc(ccc1-c1cnc(Oc2cc(Cl)cc(Cl)c2)c(Cl)c1)C(=O)NS(C)(=O)=O
Show InChI InChI=1S/C20H15Cl3N2O5S/c1-29-18-6-11(19(26)25-31(2,27)28)3-4-16(18)12-5-17(23)20(24-10-12)30-15-8-13(21)7-14(22)9-15/h3-10H,1-2H3,(H,25,26)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 34.5n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329273
PNG
(3-chloro-4-(5-chloro-6-(2,4- dichloro-6-methylphen...)
Show SMILES Cc1cc(Cl)cc(Cl)c1Oc1ncc(cc1Cl)-c1ccc(cc1Cl)C(=O)NS(C)(=O)=O
Show InChI InChI=1S/C20H14Cl4N2O4S/c1-10-5-13(21)8-16(23)18(10)30-20-17(24)7-12(9-25-20)14-4-3-11(6-15(14)22)19(27)26-31(2,28)29/h3-9H,1-2H3,(H,26,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 34.5n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329085
PNG
(4-(5-chloro-6-(3-chloro-2- methylphenoxy)-3-pyridi...)
Show SMILES Cc1c(Cl)cccc1Oc1ncc(cc1Cl)-c1ccc(cc1OC(F)F)C(=O)NS(C)(=O)=O
Show InChI InChI=1S/C21H16Cl2F2N2O5S/c1-11-15(22)4-3-5-17(11)31-20-16(23)8-13(10-26-20)14-7-6-12(9-18(14)32-21(24)25)19(28)27-33(2,29)30/h3-10,21H,1-2H3,(H,27,28)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 34.6n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329146
PNG
(4-(6-((1R)-1-(1,3-benzothiazol-2-yl)ethoxy)-5-chlo...)
Show SMILES C[C@@H](Oc1ncc(cc1Cl)-c1cc(F)c(cc1C)C(=O)NS(C)(=O)=O)c1nc2ccccc2s1
Show InChI InChI=1S/C23H19ClFN3O4S2/c1-12-8-16(21(29)28-34(3,30)31)18(25)10-15(12)14-9-17(24)22(26-11-14)32-13(2)23-27-19-6-4-5-7-20(19)33-23/h4-11,13H,1-3H3,(H,28,29)/t13-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

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DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 34.9n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329163
PNG
(4-(5-chloro-6-(2,4- dichlorophenoxy)-3-pyridinyl)-...)
Show SMILES Cc1cc(C(=O)NS(C)(=O)=O)c(F)cc1-c1cnc(Oc2ccc(Cl)cc2Cl)c(Cl)c1
Show InChI InChI=1S/C20H14Cl3FN2O4S/c1-10-5-14(19(27)26-31(2,28)29)17(24)8-13(10)11-6-16(23)20(25-9-11)30-18-4-3-12(21)7-15(18)22/h3-9H,1-2H3,(H,26,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 35.7n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329261
PNG
(4-(5-chloro-6-(2,6- dichlorophenoxy)-3-pyridinyl)-...)
Show SMILES COc1cc(C(=O)NS(C)(=O)=O)c(F)cc1-c1cnc(Oc2c(Cl)cccc2Cl)c(Cl)c1
Show InChI InChI=1S/C20H14Cl3FN2O5S/c1-30-17-8-12(19(27)26-32(2,28)29)16(24)7-11(17)10-6-15(23)20(25-9-10)31-18-13(21)4-3-5-14(18)22/h3-9H,1-2H3,(H,26,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 36.7n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329250
PNG
(4-(5-chloro-6-(4-chloro-2- fluorophenoxy)-3-pyridi...)
Show SMILES COc1cc(C(=O)NS(C)(=O)=O)c(F)cc1-c1cnc(Oc2ccc(Cl)cc2F)c(Cl)c1
Show InChI InChI=1S/C20H14Cl2F2N2O5S/c1-30-18-8-13(19(27)26-32(2,28)29)15(23)7-12(18)10-5-14(22)20(25-9-10)31-17-4-3-11(21)6-16(17)24/h3-9H,1-2H3,(H,26,27)
PDB

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n/an/a 36.9n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329235
PNG
(4-(5-chloro-6-(2,4- dichlorophenoxy)-3-pyridinyl)-...)
Show SMILES COc1cc(C(=O)NS(C)(=O)=O)c(F)cc1-c1cnc(Oc2ccc(Cl)cc2Cl)c(Cl)c1
Show InChI InChI=1S/C20H14Cl3FN2O5S/c1-30-18-8-13(19(27)26-32(2,28)29)16(24)7-12(18)10-5-15(23)20(25-9-10)31-17-4-3-11(21)6-14(17)22/h3-9H,1-2H3,(H,26,27)
PDB

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n/an/a 37n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329040
PNG
(4-(5-chloro-6-(2-chloro-5- methylphenoxy)-3-pyridi...)
Show SMILES Cc1ccc(Cl)c(Oc2ncc(cc2Cl)-c2ccc(cc2OC2COC2)C(=O)NS(C)(=O)=O)c1
Show InChI InChI=1S/C23H20Cl2N2O6S/c1-13-3-6-18(24)21(7-13)33-23-19(25)8-15(10-26-23)17-5-4-14(22(28)27-34(2,29)30)9-20(17)32-16-11-31-12-16/h3-10,16H,11-12H2,1-2H3,(H,27,28)
PDB

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n/an/a 38.6n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329290
PNG
(4-(5-chloro-6-(2,3,6-trifluorophenoxy)-3-pyridinyl...)
Show SMILES CCS(=O)(=O)NC(=O)c1ccc(c(OC)c1)-c1cnc(Oc2c(F)ccc(F)c2F)c(Cl)c1
Show InChI InChI=1S/C21H16ClF3N2O5S/c1-3-33(29,30)27-20(28)11-4-5-13(17(9-11)31-2)12-8-14(22)21(26-10-12)32-19-16(24)7-6-15(23)18(19)25/h4-10H,3H2,1-2H3,(H,27,28)
PDB

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n/an/a 39.4n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329274
PNG
(3-chloro-4-(5-chloro-6-(3,5-dichlorophenoxy)-3-pyr...)
Show SMILES CS(=O)(=O)NC(=O)c1ccc(c(Cl)c1)-c1cnc(Oc2cc(Cl)cc(Cl)c2)c(Cl)c1
Show InChI InChI=1S/C19H12Cl4N2O4S/c1-30(27,28)25-18(26)10-2-3-15(16(22)4-10)11-5-17(23)19(24-9-11)29-14-7-12(20)6-13(21)8-14/h2-9H,1H3,(H,25,26)
PDB

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n/an/a 40n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329249
PNG
(4-(5-chloro-6-(2-chloro-5-methylphenoxy)-3-pyridin...)
Show SMILES COc1cc(C(=O)NS(C)(=O)=O)c(F)cc1-c1cnc(Oc2cc(C)ccc2Cl)c(Cl)c1
Show InChI InChI=1S/C21H17Cl2FN2O5S/c1-11-4-5-15(22)19(6-11)31-21-16(23)7-12(10-25-21)13-8-17(24)14(9-18(13)30-2)20(27)26-32(3,28)29/h4-10H,1-3H3,(H,26,27)
PDB

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n/an/a 42.1n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329074
PNG
(4-(5-bromo-6-(2,4-dichloro-6- methylphenoxy)-3-pyr...)
Show SMILES Cc1cc(Cl)cc(Cl)c1Oc1ncc(cc1Br)-c1cc(F)c(cc1F)C(=O)NS(C)(=O)=O
Show InChI InChI=1S/C20H13BrCl2F2N2O4S/c1-9-3-11(22)5-15(23)18(9)31-20-14(21)4-10(8-26-20)12-6-17(25)13(7-16(12)24)19(28)27-32(2,29)30/h3-8H,1-2H3,(H,27,28)
PDB

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n/an/a 42.4n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329277
PNG
(4-(5-chloro-6-(3-chloro-2- methylphenoxy)-3-pyridi...)
Show SMILES Cc1c(Cl)cccc1Oc1ncc(cc1Cl)-c1cc(F)c(cc1OC(F)F)C(=O)NS(C)(=O)=O
Show InChI InChI=1S/C21H15Cl2F3N2O5S/c1-10-14(22)4-3-5-17(10)32-20-15(23)6-11(9-27-20)12-7-16(24)13(8-18(12)33-21(25)26)19(29)28-34(2,30)31/h3-9,21H,1-2H3,(H,28,29)
PDB

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n/an/a 44.5n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329104
PNG
(4-(5-chloro-6-(2,5- difluorophenoxy)-3-pyridinyl)-...)
Show SMILES Cc1cc(C(=O)NS(C)(=O)=O)c(F)cc1-c1cnc(Oc2cc(F)ccc2F)c(Cl)c1
Show InChI InChI=1S/C20H14ClF3N2O4S/c1-10-5-14(19(27)26-31(2,28)29)17(24)8-13(10)11-6-15(21)20(25-9-11)30-18-7-12(22)3-4-16(18)23/h3-9H,1-2H3,(H,26,27)
PDB

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n/an/a 45.5n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329037
PNG
(4-(5-chloro-6-(4-chloro-3- methylphenoxy)-3-pyridi...)
Show SMILES Cc1cc(Oc2ncc(cc2Cl)-c2ccc(cc2OC2COC2)C(=O)NS(C)(=O)=O)ccc1Cl
Show InChI InChI=1S/C23H20Cl2N2O6S/c1-13-7-16(4-6-19(13)24)33-23-20(25)8-15(10-26-23)18-5-3-14(22(28)27-34(2,29)30)9-21(18)32-17-11-31-12-17/h3-10,17H,11-12H2,1-2H3,(H,27,28)
PDB

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n/an/a 46.1n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329171
PNG
(4-(5-chloro-6-((1R)-1-(2,5-dichlorophenyl)ethoxy)-...)
Show SMILES C[C@@H](Oc1ncc(cc1Cl)-c1cc(F)c(cc1C)C(=O)NS(C)(=O)=O)c1cc(Cl)ccc1Cl
Show InChI InChI=1S/C22H18Cl3FN2O4S/c1-11-6-17(21(29)28-33(3,30)31)20(26)9-15(11)13-7-19(25)22(27-10-13)32-12(2)16-8-14(23)4-5-18(16)24/h4-10,12H,1-3H3,(H,28,29)/t12-/m1/s1
PDB

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n/an/a 46.2n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329202
PNG
(4-(5-Chloro-6-(3-Chloro-2-Methylphenoxy)Pyridin-3-...)
Show SMILES COc1cc(C(=O)NS(C)(=O)=O)c(F)cc1-c1cnc(Oc2cccc(Cl)c2C)c(Cl)c1
Show InChI InChI=1S/C21H17Cl2FN2O5S/c1-11-15(22)5-4-6-18(11)31-21-16(23)7-12(10-25-21)13-8-17(24)14(9-19(13)30-2)20(27)26-32(3,28)29/h4-10H,1-3H3,(H,26,27)
PDB

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n/an/a 46.8n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329188
PNG
(4-(6-(3-chloro-2-methylphenoxy)-5-cyano-3-pyridiny...)
Show SMILES COc1cc(ccc1-c1cnc(Oc2cccc(Cl)c2C)c(c1)C#N)C(=O)NS(C)(=O)=O
Show InChI InChI=1S/C22H18ClN3O5S/c1-13-18(23)5-4-6-19(13)31-22-15(11-24)9-16(12-25-22)17-8-7-14(10-20(17)30-2)21(27)26-32(3,28)29/h4-10,12H,1-3H3,(H,26,27)
PDB

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n/an/a 46.9n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329260
PNG
(4-(5-chloro-6-(4-chloro-3,5- difluorophenoxy)-3-py...)
Show SMILES COc1cc(C(=O)NS(C)(=O)=O)c(F)cc1-c1cnc(Oc2cc(F)c(Cl)c(F)c2)c(Cl)c1
Show InChI InChI=1S/C20H13Cl2F3N2O5S/c1-31-17-7-12(19(28)27-33(2,29)30)14(23)6-11(17)9-3-13(21)20(26-8-9)32-10-4-15(24)18(22)16(25)5-10/h3-8H,1-2H3,(H,27,28)
PDB

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n/an/a 47.1n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329084
PNG
(4-(5-chloro-6-(2,4-dichloro-6- methylphenoxy)-3-py...)
Show SMILES Cc1cc(Cl)cc(Cl)c1Oc1ncc(cc1Cl)-c1ccc(cc1OC(F)F)C(=O)NS(C)(=O)=O
Show InChI InChI=1S/C21H15Cl3F2N2O5S/c1-10-5-13(22)8-15(23)18(10)33-20-16(24)6-12(9-27-20)14-4-3-11(7-17(14)32-21(25)26)19(29)28-34(2,30)31/h3-9,21H,1-2H3,(H,28,29)
PDB

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n/an/a 47.2n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329254
PNG
(4-(5-chloro-6-((7-fluoro-2,3- dihydro-1H-inden-4-y...)
Show SMILES COc1cc(C(=O)NS(C)(=O)=O)c(F)cc1-c1cnc(Oc2ccc(F)c3CCCc23)c(Cl)c1
Show InChI InChI=1S/C23H19ClF2N2O5S/c1-32-21-10-16(22(29)28-34(2,30)31)19(26)9-15(21)12-8-17(24)23(27-11-12)33-20-7-6-18(25)13-4-3-5-14(13)20/h6-11H,3-5H2,1-2H3,(H,28,29)
PDB

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n/an/a 47.7n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329107
PNG
(4-(5-chloro-6-((2-methyl-1- naphthalenyl)oxy)-3-py...)
Show SMILES Cc1ccc2ccccc2c1Oc1ncc(cc1Cl)-c1cc(F)c(cc1C)C(=O)NS(C)(=O)=O
Show InChI InChI=1S/C25H20ClFN2O4S/c1-14-8-9-16-6-4-5-7-18(16)23(14)33-25-21(26)11-17(13-28-25)19-12-22(27)20(10-15(19)2)24(30)29-34(3,31)32/h4-13H,1-3H3,(H,29,30)
PDB

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n/an/a 48.1n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329066
PNG
(4-(5-chloro-6-(2,4,6- trichlorophenoxy)-3-pyridiny...)
Show SMILES CS(=O)(=O)NC(=O)c1cc(F)c(cc1F)-c1cnc(Oc2c(Cl)cc(Cl)cc2Cl)c(Cl)c1
Show InChI InChI=1S/C19H10Cl4F2N2O4S/c1-32(29,30)27-18(28)11-6-15(24)10(5-16(11)25)8-2-14(23)19(26-7-8)31-17-12(21)3-9(20)4-13(17)22/h2-7H,1H3,(H,27,28)
PDB

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n/an/a 48.5n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329122
PNG
(4-(5-Chloro-6-(3-Fluoro-4-Methylphenoxy)Pyridin-3-...)
Show SMILES Cc1ccc(Oc2ncc(cc2Cl)-c2cc(F)c(cc2C)C(=O)NS(C)(=O)=O)cc1F
Show InChI InChI=1S/C21H17ClF2N2O4S/c1-11-4-5-14(8-18(11)23)30-21-17(22)7-13(10-25-21)15-9-19(24)16(6-12(15)2)20(27)26-31(3,28)29/h4-10H,1-3H3,(H,26,27)
PDB

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n/an/a 48.5n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329078
PNG
(4-(5-chloro-6-(3-chloro-2-methylphenoxy)-3-pyridin...)
Show SMILES COc1cc(ccc1-c1cnc(Oc2cccc(Cl)c2C)c(Cl)c1)C(=O)NS(C)(=O)=O
Show InChI InChI=1S/C21H18Cl2N2O5S/c1-12-16(22)5-4-6-18(12)30-21-17(23)9-14(11-24-21)15-8-7-13(10-19(15)29-2)20(26)25-31(3,27)28/h4-11H,1-3H3,(H,25,26)
PDB

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n/an/a 48.6n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329093
PNG
(5-chloro-4-(5-chloro-6-(((1R)-2-methyl-1-phenylpro...)
Show SMILES CC(C)[C@@H](Oc1ncc(cc1Cl)-c1cc(F)c(cc1Cl)C(=O)NS(C)(=O)=O)c1ccccc1
Show InChI InChI=1S/C23H21Cl2FN2O4S/c1-13(2)21(14-7-5-4-6-8-14)32-23-19(25)9-15(12-27-23)16-11-20(26)17(10-18(16)24)22(29)28-33(3,30)31/h4-13,21H,1-3H3,(H,28,29)/t21-/m1/s1
PDB

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n/an/a 48.8n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329225
PNG
(4-(5-chloro-6-((4- methylphenyl)sulfanyl)-3- pyrid...)
Show SMILES COc1cc(C(=O)NS(C)(=O)=O)c(F)cc1-c1cnc(Sc2ccc(C)cc2)c(Cl)c1
Show InChI InChI=1S/C21H18ClFN2O4S2/c1-12-4-6-14(7-5-12)30-21-17(22)8-13(11-24-21)15-9-18(23)16(10-19(15)29-2)20(26)25-31(3,27)28/h4-11H,1-3H3,(H,25,26)
PDB

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UniProtKB/SwissProt

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UniChem
US Patent
n/an/a 49.5n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329164
PNG
(4-(5-chloro-6-(2-chloro-4,6- difluorophenoxy)-3-py...)
Show SMILES Cc1cc(C(=O)NS(C)(=O)=O)c(F)cc1-c1cnc(Oc2c(F)cc(F)cc2Cl)c(Cl)c1
Show InChI InChI=1S/C20H13Cl2F3N2O4S/c1-9-3-13(19(28)27-32(2,29)30)16(24)7-12(9)10-4-15(22)20(26-8-10)31-18-14(21)5-11(23)6-17(18)25/h3-8H,1-2H3,(H,27,28)
PDB

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UniProtKB/SwissProt

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US Patent
n/an/a 49.7n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329088
PNG
(5-chloro-4-(5-chloro-6-(2,3,5-trifluorophenoxy)-3-...)
Show SMILES CS(=O)(=O)NC(=O)c1cc(Cl)c(cc1F)-c1cnc(Oc2cc(F)cc(F)c2F)c(Cl)c1
Show InChI InChI=1S/C19H10Cl2F4N2O4S/c1-32(29,30)27-18(28)11-5-12(20)10(6-14(11)23)8-2-13(21)19(26-7-8)31-16-4-9(22)3-15(24)17(16)25/h2-7H,1H3,(H,27,28)
PDB

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UniProtKB/SwissProt

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US Patent
n/an/a 49.9n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329229
PNG
(4-(5-chloro-6-((1R)-1-cyclobutylethoxy)-3-pyridiny...)
Show SMILES COc1cc(C(=O)NS(C)(=O)=O)c(F)cc1-c1cnc(O[C@H](C)C2CCC2)c(Cl)c1
Show InChI InChI=1S/C20H22ClFN2O5S/c1-11(12-5-4-6-12)29-20-16(21)7-13(10-23-20)14-8-17(22)15(9-18(14)28-2)19(25)24-30(3,26)27/h7-12H,4-6H2,1-3H3,(H,24,25)/t11-/m1/s1
PDB

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UniProtKB/SwissProt

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n/an/a 50n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329292
PNG
(4-(5-chloro-6-(3,4- dichlorobenzyl)-3-pyridinyl)-3...)
Show SMILES COc1cc(ccc1-c1cnc(Cc2ccc(Cl)c(Cl)c2)c(Cl)c1)C(=O)NS(C)(=O)=O
Show InChI InChI=1S/C21H17Cl3N2O4S/c1-30-20-10-13(21(27)26-31(2,28)29)4-5-15(20)14-9-18(24)19(25-11-14)8-12-3-6-16(22)17(23)7-12/h3-7,9-11H,8H2,1-2H3,(H,26,27)
PDB

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UniProtKB/SwissProt

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n/an/a 50.4n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329028
PNG
(4-(5-chloro-6-(3-chloro-5- (trifluoromethoxy)pheno...)
Show SMILES COc1cc(ccc1-c1cnc(Oc2cc(Cl)cc(OC(F)(F)F)c2)c(Cl)c1)C(=O)NS(C)(=O)=O
Show InChI InChI=1S/C21H15Cl2F3N2O6S/c1-32-18-6-11(19(29)28-35(2,30)31)3-4-16(18)12-5-17(23)20(27-10-12)33-14-7-13(22)8-15(9-14)34-21(24,25)26/h3-10H,1-2H3,(H,28,29)
PDB

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UniProtKB/SwissProt

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n/an/a 50.4n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329063
PNG
(4-(6-(3-chloro-4- methylphenoxy)-5-cyano-3- pyridi...)
Show SMILES COc1cc(ccc1-c1cnc(Oc2ccc(C)c(Cl)c2)c(c1)C#N)C(=O)NS(C)(=O)=O
Show InChI InChI=1S/C22H18ClN3O5S/c1-13-4-6-17(10-19(13)23)31-22-15(11-24)8-16(12-25-22)18-7-5-14(9-20(18)30-2)21(27)26-32(3,28)29/h4-10,12H,1-3H3,(H,26,27)
PDB

KEGG

UniProtKB/SwissProt

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n/an/a 50.5n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
nav 1.7 px


(Homo sapiens (Human))
BDBM329063
PNG
(4-(6-(3-chloro-4- methylphenoxy)-5-cyano-3- pyridi...)
Show SMILES COc1cc(ccc1-c1cnc(Oc2ccc(C)c(Cl)c2)c(c1)C#N)C(=O)NS(C)(=O)=O
Show InChI InChI=1S/C22H18ClN3O5S/c1-13-4-6-17(10-19(13)23)31-22-15(11-24)8-16(12-25-22)18-7-5-14(9-20(18)30-2)21(27)26-32(3,28)29/h4-10,12H,1-3H3,(H,26,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 50.5n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
HEK 293 cells stably transfected with human Nav1.7 were recorded in whole cell voltage clamp mode with the PatchXpress automated electrophysiology sy...


US Patent US9663508 (2017)

More data for this
Ligand-Target Pair
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