BindingDB logo
myBDB logout

Patent code US9656968

Compile Data Set for Download or QSAR
Found 122 hits of Enzyme Inhibition Constant Data   
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))
BDBM185975
PNG
(US9163008, 64 | US9656968, Compound 64)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2ccc(Cl)cc2F)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C20H17ClFN5O3/c1-10(18(23)28)25-17-9-15(19(24)29)26-20(27-17)11-2-5-13(6-3-11)30-16-7-4-12(21)8-14(16)22/h2-10H,1H3,(H2,23,28)(H2,24,29)(H,25,26,27)/t10-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
16n/an/an/an/an/an/an/an/a



TBA

US Patent


Assay Description
Cells: The hNav1.7 expressing HEK-293 cells were plated on 35 mm culture dishes pre-coated with poly-D-lysine in standard DMEM culture media (Mediate...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185953
PNG
(US9163008, 42 | US9656968, Compound 42)
Show SMILES C[C@@H](CO)Nc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O
Show InChI InChI=1S/C20H19FN4O3/c1-12(11-26)23-18-10-17(19(22)27)24-20(25-18)13-2-6-15(7-3-13)28-16-8-4-14(21)5-9-16/h2-10,12,26H,11H2,1H3,(H2,22,27)(H,23,24,25)/t12-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
24n/an/an/an/an/an/an/an/a



TBA

US Patent


Assay Description
Cells: The hNav1.7 expressing HEK-293 cells were plated on 35 mm culture dishes pre-coated with poly-D-lysine in standard DMEM culture media (Mediate...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185925
PNG
(US9163008, 14 | US9656968, Compound 14)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2ccc(cc2)C(F)(F)F)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C21H18F3N5O3/c1-11(18(25)30)27-17-10-16(19(26)31)28-20(29-17)12-2-6-14(7-3-12)32-15-8-4-13(5-9-15)21(22,23)24/h2-11H,1H3,(H2,25,30)(H2,26,31)(H,27,28,29)/t11-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
24n/an/an/an/an/an/an/an/a



TBA

US Patent


Assay Description
Cells: The hNav1.7 expressing HEK-293 cells were plated on 35 mm culture dishes pre-coated with poly-D-lysine in standard DMEM culture media (Mediate...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185967
PNG
(US9163008, 56 | US9656968, Compound 56)
Show SMILES C[C@H](Oc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C20H17FN4O4/c1-11(18(22)26)28-17-10-16(19(23)27)24-20(25-17)12-2-6-14(7-3-12)29-15-8-4-13(21)5-9-15/h2-11H,1H3,(H2,22,26)(H2,23,27)/t11-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
53n/an/an/an/an/an/an/an/a



TBA

US Patent


Assay Description
Cells: The hNav1.7 expressing HEK-293 cells were plated on 35 mm culture dishes pre-coated with poly-D-lysine in standard DMEM culture media (Mediate...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185918
PNG
(US9163008, 7 | US9656968, Compound 7)
Show SMILES NC(=O)c1cc(N[C@H]2CCNC2=O)nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1
Show InChI InChI=1S/C21H18FN5O3/c22-13-3-7-15(8-4-13)30-14-5-1-12(2-6-14)20-26-17(19(23)28)11-18(27-20)25-16-9-10-24-21(16)29/h1-8,11,16H,9-10H2,(H2,23,28)(H,24,29)(H,25,26,27)/t16-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
53n/an/an/an/an/an/an/an/a



TBA

US Patent


Assay Description
Cells: The hNav1.7 expressing HEK-293 cells were plated on 35 mm culture dishes pre-coated with poly-D-lysine in standard DMEM culture media (Mediate...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM186009
PNG
(US9163008, 98 | US9656968, Compound 98)
Show SMILES C[C@H](Oc1cc(nc(n1)-c1ccc(Oc2ccc(cc2)C(F)(F)F)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C21H17F3N4O4/c1-11(18(25)29)31-17-10-16(19(26)30)27-20(28-17)12-2-6-14(7-3-12)32-15-8-4-13(5-9-15)21(22,23)24/h2-11H,1H3,(H2,25,29)(H2,26,30)/t11-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
54n/an/an/an/an/an/an/an/a



TBA

US Patent


Assay Description
Cells: The hNav1.7 expressing HEK-293 cells were plated on 35 mm culture dishes pre-coated with poly-D-lysine in standard DMEM culture media (Mediate...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185912
PNG
(US9163008, 1 | US9656968, Compound 1)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C20H18FN5O3/c1-11(18(22)27)24-17-10-16(19(23)28)25-20(26-17)12-2-6-14(7-3-12)29-15-8-4-13(21)5-9-15/h2-11H,1H3,(H2,22,27)(H2,23,28)(H,24,25,26)/t11-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
57n/an/an/an/an/an/an/an/a



TBA

US Patent


Assay Description
Cells: The hNav1.7 expressing HEK-293 cells were plated on 35 mm culture dishes pre-coated with poly-D-lysine in standard DMEM culture media (Mediate...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185949
PNG
(US9163008, 38 | US9656968, Compound 38)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2cc(Cl)ccc2F)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C20H17ClFN5O3/c1-10(18(23)28)25-17-9-15(19(24)29)26-20(27-17)11-2-5-13(6-3-11)30-16-8-12(21)4-7-14(16)22/h2-10H,1H3,(H2,23,28)(H2,24,29)(H,25,26,27)/t10-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
67n/an/an/an/an/an/an/an/a



TBA

US Patent


Assay Description
Cells: The hNav1.7 expressing HEK-293 cells were plated on 35 mm culture dishes pre-coated with poly-D-lysine in standard DMEM culture media (Mediate...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185916
PNG
(US9163008, 5 | US9656968, Compound 5)
Show SMILES NC(=O)[C@@H]1CCCN1c1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O
Show InChI InChI=1S/C22H20FN5O3/c23-14-5-9-16(10-6-14)31-15-7-3-13(4-8-15)22-26-17(20(24)29)12-19(27-22)28-11-1-2-18(28)21(25)30/h3-10,12,18H,1-2,11H2,(H2,24,29)(H2,25,30)/t18-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
78n/an/an/an/an/an/an/an/a



TBA

US Patent


Assay Description
Cells: The hNav1.7 expressing HEK-293 cells were plated on 35 mm culture dishes pre-coated with poly-D-lysine in standard DMEM culture media (Mediate...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM186010
PNG
(US9163008, 99 | US9656968, Compound 99)
Show SMILES NC(=O)c1cc(N[C@H]2CCNC2=O)nc(n1)-c1ccc(Oc2ccc(cn2)C(F)(F)F)cc1
Show InChI InChI=1S/C21H17F3N6O3/c22-21(23,24)12-3-6-17(27-10-12)33-13-4-1-11(2-5-13)19-29-15(18(25)31)9-16(30-19)28-14-7-8-26-20(14)32/h1-6,9-10,14H,7-8H2,(H2,25,31)(H,26,32)(H,28,29,30)/t14-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
83n/an/an/an/an/an/an/an/a



TBA

US Patent


Assay Description
Cells: The hNav1.7 expressing HEK-293 cells were plated on 35 mm culture dishes pre-coated with poly-D-lysine in standard DMEM culture media (Mediate...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185932
PNG
(US9163008, 21 | US9656968, Compound 21)
Show SMILES C[C@@H](Nc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C20H18FN5O3/c1-11(18(22)27)24-17-10-16(19(23)28)25-20(26-17)12-2-6-14(7-3-12)29-15-8-4-13(21)5-9-15/h2-11H,1H3,(H2,22,27)(H2,23,28)(H,24,25,26)/t11-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
230n/an/an/an/an/an/an/an/a



TBA

US Patent


Assay Description
Cells: The hNav1.7 expressing HEK-293 cells were plated on 35 mm culture dishes pre-coated with poly-D-lysine in standard DMEM culture media (Mediate...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185917
PNG
(US9163008, 6 | US9656968, Compound 6)
Show SMILES Cn1cnc(C[C@H](Nc2cc(nc(n2)-c2ccc(Oc3ccc(F)cc3)cc2)C(N)=O)C(N)=O)c1
Show InChI InChI=1S/C24H22FN7O3/c1-32-12-16(28-13-32)10-19(22(26)33)29-21-11-20(23(27)34)30-24(31-21)14-2-6-17(7-3-14)35-18-8-4-15(25)5-9-18/h2-9,11-13,19H,10H2,1H3,(H2,26,33)(H2,27,34)(H,29,30,31)/t19-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
250n/an/an/an/an/an/an/an/a



TBA

US Patent


Assay Description
Cells: The hNav1.7 expressing HEK-293 cells were plated on 35 mm culture dishes pre-coated with poly-D-lysine in standard DMEM culture media (Mediate...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185964
PNG
(US9163008, 53 | US9656968, Compound 53)
Show SMILES CS(=O)(=O)N(CC(O)CO)c1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O
Show InChI InChI=1S/C21H21FN4O6S/c1-33(30,31)26(11-15(28)12-27)19-10-18(20(23)29)24-21(25-19)13-2-6-16(7-3-13)32-17-8-4-14(22)5-9-17/h2-10,15,27-28H,11-12H2,1H3,(H2,23,29)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
270n/an/an/an/an/an/an/an/a



TBA

US Patent


Assay Description
Cells: The hNav1.7 expressing HEK-293 cells were plated on 35 mm culture dishes pre-coated with poly-D-lysine in standard DMEM culture media (Mediate...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185926
PNG
(US9163008, 15 | US9656968, Compound 15)
Show SMILES COC(=O)[C@@H]1CCCN1c1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O
Show InChI InChI=1S/C23H21FN4O4/c1-31-23(30)19-3-2-12-28(19)20-13-18(21(25)29)26-22(27-20)14-4-8-16(9-5-14)32-17-10-6-15(24)7-11-17/h4-11,13,19H,2-3,12H2,1H3,(H2,25,29)/t19-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
350n/an/an/an/an/an/an/an/a



TBA

US Patent


Assay Description
Cells: The hNav1.7 expressing HEK-293 cells were plated on 35 mm culture dishes pre-coated with poly-D-lysine in standard DMEM culture media (Mediate...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185924
PNG
(US9163008, 13 | US9656968, Compound 13)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2ccc(cn2)C(F)(F)F)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C20H17F3N6O3/c1-10(17(24)30)27-15-8-14(18(25)31)28-19(29-15)11-2-5-13(6-3-11)32-16-7-4-12(9-26-16)20(21,22)23/h2-10H,1H3,(H2,24,30)(H2,25,31)(H,27,28,29)/t10-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
420n/an/an/an/an/an/an/an/a



TBA

US Patent


Assay Description
Cells: The hNav1.7 expressing HEK-293 cells were plated on 35 mm culture dishes pre-coated with poly-D-lysine in standard DMEM culture media (Mediate...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185913
PNG
(US9163008, 2 | US9656968, Compound 2)
Show SMILES NC(=O)CNc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O
Show InChI InChI=1S/C19H16FN5O3/c20-12-3-7-14(8-4-12)28-13-5-1-11(2-6-13)19-24-15(18(22)27)9-17(25-19)23-10-16(21)26/h1-9H,10H2,(H2,21,26)(H2,22,27)(H,23,24,25)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
590n/an/an/an/an/an/an/an/a



TBA

US Patent


Assay Description
Cells: The hNav1.7 expressing HEK-293 cells were plated on 35 mm culture dishes pre-coated with poly-D-lysine in standard DMEM culture media (Mediate...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185974
PNG
(US9163008, 63 | US9656968, Compound 63)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2ccc(Cl)cn2)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C19H17ClN6O3/c1-10(17(21)27)24-15-8-14(18(22)28)25-19(26-15)11-2-5-13(6-3-11)29-16-7-4-12(20)9-23-16/h2-10H,1H3,(H2,21,27)(H2,22,28)(H,24,25,26)/t10-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
600n/an/an/an/an/an/an/an/a



TBA

US Patent


Assay Description
Cells: The hNav1.7 expressing HEK-293 cells were plated on 35 mm culture dishes pre-coated with poly-D-lysine in standard DMEM culture media (Mediate...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185946
PNG
(US9163008, 35 | US9656968, Compound 35)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(O)=O)C(N)=O
Show InChI InChI=1S/C20H17FN4O4/c1-11(18(22)26)23-17-10-16(20(27)28)24-19(25-17)12-2-6-14(7-3-12)29-15-8-4-13(21)5-9-15/h2-11H,1H3,(H2,22,26)(H,27,28)(H,23,24,25)/t11-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
2.05E+4n/an/an/an/an/an/an/an/a



TBA

US Patent


Assay Description
Cells: The hNav1.7 expressing HEK-293 cells were plated on 35 mm culture dishes pre-coated with poly-D-lysine in standard DMEM culture media (Mediate...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185942
PNG
(US9163008, 31 | US9656968, Compound 40)
Show SMILES NC(=O)c1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)N1[C@@H](Cc2ccccc12)C(O)=O
Show InChI InChI=1S/C26H19FN4O4/c27-17-7-11-19(12-8-17)35-18-9-5-15(6-10-18)25-29-20(24(28)32)14-23(30-25)31-21-4-2-1-3-16(21)13-22(31)26(33)34/h1-12,14,22H,13H2,(H2,28,32)(H,33,34)/t22-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
4.11E+4n/an/an/an/an/an/an/an/a



TBA

US Patent


Assay Description
Cells: The hNav1.7 expressing HEK-293 cells were plated on 35 mm culture dishes pre-coated with poly-D-lysine in standard DMEM culture media (Mediate...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185952
PNG
(US9163008, 41 | US9656968, Compound 41)
Show SMILES NC(=O)c1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)N1CCOCC1CO
Show InChI InChI=1S/C22H21FN4O4/c23-15-3-7-18(8-4-15)31-17-5-1-14(2-6-17)22-25-19(21(24)29)11-20(26-22)27-9-10-30-13-16(27)12-28/h1-8,11,16,28H,9-10,12-13H2,(H2,24,29)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 37n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185953
PNG
(US9163008, 42 | US9656968, Compound 42)
Show SMILES C[C@@H](CO)Nc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O
Show InChI InChI=1S/C20H19FN4O3/c1-12(11-26)23-18-10-17(19(22)27)24-20(25-18)13-2-6-15(7-3-13)28-16-8-4-14(21)5-9-16/h2-10,12,26H,11H2,1H3,(H2,22,27)(H,23,24,25)/t12-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 69n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM186004
PNG
(US9163008, 93 | US9656968, Compound 93)
Show SMILES C[C@H](Oc1cc(nc(n1)-c1ccc(Oc2ccc(Cl)cc2F)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C20H16ClFN4O4/c1-10(18(23)27)29-17-9-15(19(24)28)25-20(26-17)11-2-5-13(6-3-11)30-16-7-4-12(21)8-14(16)22/h2-10H,1H3,(H2,23,27)(H2,24,28)/t10-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 83n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185963
PNG
(US9163008, 52 | US9656968, Compound 52)
Show SMILES CC1(C)OCC(CN(c2cc(nc(n2)-c2ccc(Oc3ccc(F)cc3)cc2)C(N)=O)S(C)(=O)=O)O1
Show InChI InChI=1S/C24H25FN4O6S/c1-24(2)33-14-19(35-24)13-29(36(3,31)32)21-12-20(22(26)30)27-23(28-21)15-4-8-17(9-5-15)34-18-10-6-16(25)7-11-18/h4-12,19H,13-14H2,1-3H3,(H2,26,30)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 88n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185928
PNG
(US9163008, 17 | US9656968, Compound 17)
Show SMILES CCOC(=O)C1(CC1)Nc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O
Show InChI InChI=1S/C23H21FN4O4/c1-2-31-22(30)23(11-12-23)28-19-13-18(20(25)29)26-21(27-19)14-3-7-16(8-4-14)32-17-9-5-15(24)6-10-17/h3-10,13H,2,11-12H2,1H3,(H2,25,29)(H,26,27,28)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 100n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185955
PNG
(US9163008, 44 | US9656968, Compound 44)
Show SMILES CC(C)(O)CNc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O
Show InChI InChI=1S/C21H21FN4O3/c1-21(2,28)12-24-18-11-17(19(23)27)25-20(26-18)13-3-7-15(8-4-13)29-16-9-5-14(22)6-10-16/h3-11,28H,12H2,1-2H3,(H2,23,27)(H,24,25,26)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 110n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185949
PNG
(US9163008, 38 | US9656968, Compound 38)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2cc(Cl)ccc2F)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C20H17ClFN5O3/c1-10(18(23)28)25-17-9-15(19(24)29)26-20(27-17)11-2-5-13(6-3-11)30-16-8-12(21)4-7-14(16)22/h2-10H,1H3,(H2,23,28)(H2,24,29)(H,25,26,27)/t10-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 110n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185989
PNG
(US9163008, 78 | US9656968, Compound 78)
Show SMILES NC(=O)[C@@H]1CCCN1c1cc(nc(n1)-c1ccc(Oc2ccc(Cl)cc2F)cc1)C(N)=O
Show InChI InChI=1S/C22H19ClFN5O3/c23-13-5-8-18(15(24)10-13)32-14-6-3-12(4-7-14)22-27-16(20(25)30)11-19(28-22)29-9-1-2-17(29)21(26)31/h3-8,10-11,17H,1-2,9H2,(H2,25,30)(H2,26,31)/t17-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 120n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185986
PNG
(US9163008, 75 | US9656968, Compound 75)
Show SMILES NC(=O)c1cc(N[C@H]2CCNC2=O)nc(n1)-c1ccc(Oc2ccc(Cl)cc2F)cc1
Show InChI InChI=1S/C21H17ClFN5O3/c22-12-3-6-17(14(23)9-12)31-13-4-1-11(2-5-13)20-27-16(19(24)29)10-18(28-20)26-15-7-8-25-21(15)30/h1-6,9-10,15H,7-8H2,(H2,24,29)(H,25,30)(H,26,27,28)/t15-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 120n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185917
PNG
(US9163008, 6 | US9656968, Compound 6)
Show SMILES Cn1cnc(C[C@H](Nc2cc(nc(n2)-c2ccc(Oc3ccc(F)cc3)cc2)C(N)=O)C(N)=O)c1
Show InChI InChI=1S/C24H22FN7O3/c1-32-12-16(28-13-32)10-19(22(26)33)29-21-11-20(23(27)34)30-24(31-21)14-2-6-17(7-3-14)35-18-8-4-15(25)5-9-18/h2-9,11-13,19H,10H2,1H3,(H2,26,33)(H2,27,34)(H,29,30,31)/t19-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 130n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185998
PNG
(US9163008, 87 | US9656968, Compound 87)
Show SMILES NC(=O)[C@@H]1CCCN1c1cc(nc(n1)-c1ccc(Oc2cc(Cl)ccc2F)cc1)C(N)=O
Show InChI InChI=1S/C22H19ClFN5O3/c23-13-5-8-15(24)18(10-13)32-14-6-3-12(4-7-14)22-27-16(20(25)30)11-19(28-22)29-9-1-2-17(29)21(26)31/h3-8,10-11,17H,1-2,9H2,(H2,25,30)(H2,26,31)/t17-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 140n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185964
PNG
(US9163008, 53 | US9656968, Compound 53)
Show SMILES CS(=O)(=O)N(CC(O)CO)c1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O
Show InChI InChI=1S/C21H21FN4O6S/c1-33(30,31)26(11-15(28)12-27)19-10-18(20(23)29)24-21(25-19)13-2-6-16(7-3-13)32-17-8-4-14(22)5-9-17/h2-10,15,27-28H,11-12H2,1H3,(H2,23,29)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 140n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185954
PNG
(US9163008, 43 | US9656968, Compound 43)
Show SMILES NC(=O)c1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)N1CCC[C@H]1CO
Show InChI InChI=1S/C22H21FN4O3/c23-15-5-9-18(10-6-15)30-17-7-3-14(4-8-17)22-25-19(21(24)29)12-20(26-22)27-11-1-2-16(27)13-28/h3-10,12,16,28H,1-2,11,13H2,(H2,24,29)/t16-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 150n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185987
PNG
(US9163008, 76 | US9656968, Compound 76)
Show SMILES C[C@H](Oc1cc(nc(n1)-c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C21H17F3N4O5/c1-11(18(25)29)31-17-10-16(19(26)30)27-20(28-17)12-2-4-13(5-3-12)32-14-6-8-15(9-7-14)33-21(22,23)24/h2-11H,1H3,(H2,25,29)(H2,26,30)/t11-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 160n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM186009
PNG
(US9163008, 98 | US9656968, Compound 98)
Show SMILES C[C@H](Oc1cc(nc(n1)-c1ccc(Oc2ccc(cc2)C(F)(F)F)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C21H17F3N4O4/c1-11(18(25)29)31-17-10-16(19(26)30)27-20(28-17)12-2-6-14(7-3-12)32-15-8-4-13(5-9-15)21(22,23)24/h2-11H,1H3,(H2,25,29)(H2,26,30)/t11-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 170n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185960
PNG
(US9163008, 49 | US9656968, Compound 49)
Show SMILES NC(=O)c1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)N1CC(O)C(O)C1
Show InChI InChI=1S/C21H19FN4O4/c22-13-3-7-15(8-4-13)30-14-5-1-12(2-6-14)21-24-16(20(23)29)9-19(25-21)26-10-17(27)18(28)11-26/h1-9,17-18,27-28H,10-11H2,(H2,23,29)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 170n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185959
PNG
(US9163008, 48 | US9656968, Compound 48)
Show SMILES NC(=O)c1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)N1CCNCC1CO
Show InChI InChI=1S/C22H22FN5O3/c23-15-3-7-18(8-4-15)31-17-5-1-14(2-6-17)22-26-19(21(24)30)11-20(27-22)28-10-9-25-12-16(28)13-29/h1-8,11,16,25,29H,9-10,12-13H2,(H2,24,30)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 170n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185925
PNG
(US9163008, 14 | US9656968, Compound 14)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2ccc(cc2)C(F)(F)F)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C21H18F3N5O3/c1-11(18(25)30)27-17-10-16(19(26)31)28-20(29-17)12-2-6-14(7-3-12)32-15-8-4-13(5-9-15)21(22,23)24/h2-11H,1H3,(H2,25,30)(H2,26,31)(H,27,28,29)/t11-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 170n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185918
PNG
(US9163008, 7 | US9656968, Compound 7)
Show SMILES NC(=O)c1cc(N[C@H]2CCNC2=O)nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1
Show InChI InChI=1S/C21H18FN5O3/c22-13-3-7-15(8-4-13)30-14-5-1-12(2-6-14)20-26-17(19(23)28)11-18(27-20)25-16-9-10-24-21(16)29/h1-8,11,16H,9-10H2,(H2,23,28)(H,24,29)(H,25,26,27)/t16-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 170n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185995
PNG
(US9163008, 84 | US9656968, Compound 84)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C21H18F3N5O4/c1-11(18(25)30)27-17-10-16(19(26)31)28-20(29-17)12-2-4-13(5-3-12)32-14-6-8-15(9-7-14)33-21(22,23)24/h2-11H,1H3,(H2,25,30)(H2,26,31)(H,27,28,29)/t11-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 180n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185975
PNG
(US9163008, 64 | US9656968, Compound 64)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2ccc(Cl)cc2F)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C20H17ClFN5O3/c1-10(18(23)28)25-17-9-15(19(24)29)26-20(27-17)11-2-5-13(6-3-11)30-16-7-4-12(21)8-14(16)22/h2-10H,1H3,(H2,23,28)(H2,24,29)(H,25,26,27)/t10-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 180n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185921
PNG
(US9163008, 10 | US9656968, Compound 10)
Show SMILES CC(C)(Nc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C21H20FN5O3/c1-21(2,20(24)29)27-17-11-16(18(23)28)25-19(26-17)12-3-7-14(8-4-12)30-15-9-5-13(22)6-10-15/h3-11H,1-2H3,(H2,23,28)(H2,24,29)(H,25,26,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 180n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185929
PNG
(US9163008, 18 | US9656968, Compound 18)
Show SMILES COC(=O)C(C)(C)Nc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O
Show InChI InChI=1S/C22H21FN4O4/c1-22(2,21(29)30-3)27-18-12-17(19(24)28)25-20(26-18)13-4-8-15(9-5-13)31-16-10-6-14(23)7-11-16/h4-12H,1-3H3,(H2,24,28)(H,25,26,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 200n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM186002
PNG
(US9163008, 91 | US9656968, Compound 91)
Show SMILES NC(=O)[C@@H]1CCCN1c1cc(nc(n1)-c1ccc(Oc2ccc(cc2)C(F)(F)F)cc1)C(N)=O
Show InChI InChI=1S/C23H20F3N5O3/c24-23(25,26)14-5-9-16(10-6-14)34-15-7-3-13(4-8-15)22-29-17(20(27)32)12-19(30-22)31-11-1-2-18(31)21(28)33/h3-10,12,18H,1-2,11H2,(H2,27,32)(H2,28,33)/t18-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 200n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185996
PNG
(US9163008, 85 | US9656968, Compound 85)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2ccc3OCOc3c2)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C21H19N5O5/c1-11(19(22)27)24-18-9-15(20(23)28)25-21(26-18)12-2-4-13(5-3-12)31-14-6-7-16-17(8-14)30-10-29-16/h2-9,11H,10H2,1H3,(H2,22,27)(H2,23,28)(H,24,25,26)/t11-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 210n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM186013
PNG
(US9163008, 102 | US9656968, Compound 102)
Show SMILES NC(=O)c1cc(O[C@H]2CCNC2=O)nc(n1)C1=CCC(CC1)Oc1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C22H21F3N4O4/c23-22(24,25)13-3-7-15(8-4-13)32-14-5-1-12(2-6-14)20-28-16(19(26)30)11-18(29-20)33-17-9-10-27-21(17)31/h1,3-4,7-8,11,14,17H,2,5-6,9-10H2,(H2,26,30)(H,27,31)/t14?,17-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 220n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185931
PNG
(US9163008, 20 | US9656968, Compound 20)
Show SMILES C[C@H](N(C)c1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C21H20FN5O3/c1-12(19(23)28)27(2)18-11-17(20(24)29)25-21(26-18)13-3-7-15(8-4-13)30-16-9-5-14(22)6-10-16/h3-12H,1-2H3,(H2,23,28)(H2,24,29)/t12-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 220n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185967
PNG
(US9163008, 56 | US9656968, Compound 56)
Show SMILES C[C@H](Oc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C20H17FN4O4/c1-11(18(22)26)28-17-10-16(19(23)27)24-20(25-17)12-2-6-14(7-3-12)29-15-8-4-13(21)5-9-15/h2-11H,1H3,(H2,22,26)(H2,23,27)/t11-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 220n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185956
PNG
(US9163008, 45 | US9656968, Compound 45)
Show SMILES NC(=O)c1cc(NCC2(O)CCCCC2)nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1
Show InChI InChI=1S/C24H25FN4O3/c25-17-6-10-19(11-7-17)32-18-8-4-16(5-9-18)23-28-20(22(26)30)14-21(29-23)27-15-24(31)12-2-1-3-13-24/h4-11,14,31H,1-3,12-13,15H2,(H2,26,30)(H,27,28,29)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 220n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185985
PNG
(US9163008, 74 | US9656968, Compound 74)
Show SMILES NC(=O)C1CN(CCN1)c1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O
Show InChI InChI=1S/C22H21FN6O3/c23-14-3-7-16(8-4-14)32-15-5-1-13(2-6-15)22-27-17(20(24)30)11-19(28-22)29-10-9-26-18(12-29)21(25)31/h1-8,11,18,26H,9-10,12H2,(H2,24,30)(H2,25,31)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 250n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185916
PNG
(US9163008, 5 | US9656968, Compound 5)
Show SMILES NC(=O)[C@@H]1CCCN1c1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O
Show InChI InChI=1S/C22H20FN5O3/c23-14-5-9-16(10-6-14)31-15-7-3-13(4-8-15)22-26-17(20(24)29)12-19(27-22)28-11-1-2-18(28)21(25)30/h3-10,12,18H,1-2,11H2,(H2,24,29)(H2,25,30)/t18-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 260n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185938
PNG
(US9163008, 27 | US9656968, Compound 27)
Show SMILES NC(=O)C1CNCCN1c1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O
Show InChI InChI=1S/C22H21FN6O3/c23-14-3-7-16(8-4-14)32-15-5-1-13(2-6-15)22-27-17(20(24)30)11-19(28-22)29-10-9-26-12-18(29)21(25)31/h1-8,11,18,26H,9-10,12H2,(H2,24,30)(H2,25,31)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 260n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185937
PNG
(US9163008, 26 | US9656968, Compound 26)
Show SMILES NC(=O)C1CN(CCO1)c1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O
Show InChI InChI=1S/C22H20FN5O4/c23-14-3-7-16(8-4-14)32-15-5-1-13(2-6-15)22-26-17(20(24)29)11-19(27-22)28-9-10-31-18(12-28)21(25)30/h1-8,11,18H,9-10,12H2,(H2,24,29)(H2,25,30)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 260n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM186003
PNG
(US9163008, 92 | US9656968, Compound 92)
Show SMILES C[C@H](Oc1cc(nc(n1)-c1ccc(Oc2cc(Cl)ccc2F)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C20H16ClFN4O4/c1-10(18(23)27)29-17-9-15(19(24)28)25-20(26-17)11-2-5-13(6-3-11)30-16-8-12(21)4-7-14(16)22/h2-10H,1H3,(H2,23,27)(H2,24,28)/t10-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 270n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185988
PNG
(US9163008, 77 | US9656968, Compound 77)
Show SMILES C[C@H](Oc1cc(nc(n1)-c1ccc(Oc2ccc(cc2)C#N)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C21H17N5O4/c1-12(19(23)27)29-18-10-17(20(24)28)25-21(26-18)14-4-8-16(9-5-14)30-15-6-2-13(11-22)3-7-15/h2-10,12H,1H3,(H2,23,27)(H2,24,28)/t12-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 290n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185934
PNG
(US9163008, 23 | US9656968, Compound 23)
Show SMILES CC(CC(N)=O)Nc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O
Show InChI InChI=1S/C21H20FN5O3/c1-12(10-18(23)28)25-19-11-17(20(24)29)26-21(27-19)13-2-6-15(7-3-13)30-16-8-4-14(22)5-9-16/h2-9,11-12H,10H2,1H3,(H2,23,28)(H2,24,29)(H,25,26,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 300n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185994
PNG
(US9163008, 83 | US9656968, Compound 83)
Show SMILES CN1CCN(C(C1)C(N)=O)c1cc(nc(n1)-c1ccc(Oc2ccc(Cl)cc2F)cc1)C(N)=O
Show InChI InChI=1S/C23H22ClFN6O3/c1-30-8-9-31(18(12-30)22(27)33)20-11-17(21(26)32)28-23(29-20)13-2-5-15(6-3-13)34-19-7-4-14(24)10-16(19)25/h2-7,10-11,18H,8-9,12H2,1H3,(H2,26,32)(H2,27,33)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 310n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185993
PNG
(US9163008, 82 | US9656968, Compound 82)
Show SMILES CN1CCN(C(C1)C(N)=O)c1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O
Show InChI InChI=1S/C23H23FN6O3/c1-29-10-11-30(19(13-29)22(26)32)20-12-18(21(25)31)27-23(28-20)14-2-6-16(7-3-14)33-17-8-4-15(24)5-9-17/h2-9,12,19H,10-11,13H2,1H3,(H2,25,31)(H2,26,32)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 340n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185920
PNG
(US9163008, 9 | US9656968, Compound 9)
Show SMILES NC(=O)c1cc(NC2(CCC2)C(N)=O)nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1
Show InChI InChI=1S/C22H20FN5O3/c23-14-4-8-16(9-5-14)31-15-6-2-13(3-7-15)20-26-17(19(24)29)12-18(27-20)28-22(21(25)30)10-1-11-22/h2-9,12H,1,10-11H2,(H2,24,29)(H2,25,30)(H,26,27,28)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 350n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185997
PNG
(US9163008, 86 | US9656968, Compound 86)
Show SMILES NC(=O)C1CNCCN1c1cc(nc(n1)-c1ccc(Oc2ccc(cc2)C(F)(F)F)cc1)C(N)=O
Show InChI InChI=1S/C23H21F3N6O3/c24-23(25,26)14-3-7-16(8-4-14)35-15-5-1-13(2-6-15)22-30-17(20(27)33)11-19(31-22)32-10-9-29-12-18(32)21(28)34/h1-8,11,18,29H,9-10,12H2,(H2,27,33)(H2,28,34)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 360n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185936
PNG
(US9163008, 25 | US9656968, Compound 25)
Show SMILES NC(=O)C1COCCN1c1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O
Show InChI InChI=1S/C22H20FN5O4/c23-14-3-7-16(8-4-14)32-15-5-1-13(2-6-15)22-26-17(20(24)29)11-19(27-22)28-9-10-31-12-18(28)21(25)30/h1-8,11,18H,9-10,12H2,(H2,24,29)(H2,25,30)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 360n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185991
PNG
(US9163008, 80 | US9656968, Compound 80)
Show SMILES NC(=O)c1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)N1C[C@@H](O)[C@H](O)C1
Show InChI InChI=1S/C21H19FN4O4/c22-13-3-7-15(8-4-13)30-14-5-1-12(2-6-14)21-24-16(20(23)29)9-19(25-21)26-10-17(27)18(28)11-26/h1-9,17-18,27-28H,10-11H2,(H2,23,29)/t17-,18-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 380n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185914
PNG
(US9163008, 3 | US9656968, Compound 3)
Show SMILES CC(C)C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C23H24FN5O3/c1-13(2)11-18(21(25)30)27-20-12-19(22(26)31)28-23(29-20)14-3-7-16(8-4-14)32-17-9-5-15(24)6-10-17/h3-10,12-13,18H,11H2,1-2H3,(H2,25,30)(H2,26,31)(H,27,28,29)/t18-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 390n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185913
PNG
(US9163008, 2 | US9656968, Compound 2)
Show SMILES NC(=O)CNc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O
Show InChI InChI=1S/C19H16FN5O3/c20-12-3-7-14(8-4-12)28-13-5-1-11(2-6-13)19-24-15(18(22)27)9-17(25-19)23-10-16(21)26/h1-9H,10H2,(H2,21,26)(H2,22,27)(H,23,24,25)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 400n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185923
PNG
(US9163008, 12 | US9656968, Compound 12)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2ccc(c(c2)C#N)C(F)(F)F)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C22H17F3N6O3/c1-11(19(27)32)29-18-9-17(20(28)33)30-21(31-18)12-2-4-14(5-3-12)34-15-6-7-16(22(23,24)25)13(8-15)10-26/h2-9,11H,1H3,(H2,27,32)(H2,28,33)(H,29,30,31)/t11-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 400n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185990
PNG
(US9163008, 79 | US9656968, Compound 79)
Show SMILES NC(=O)c1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)N1C[C@H](O)[C@@H](O)C1
Show InChI InChI=1S/C21H19FN4O4/c22-13-3-7-15(8-4-13)30-14-5-1-12(2-6-14)21-24-16(20(23)29)9-19(25-21)26-10-17(27)18(28)11-26/h1-9,17-18,27-28H,10-11H2,(H2,23,29)/t17-,18-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 410n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185977
PNG
(US9163008, 66 | US9656968, Compound 66)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2ccc(cc2)[N+]#[C-])cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C21H18N6O3/c1-12(19(22)28)25-18-11-17(20(23)29)26-21(27-18)13-3-7-15(8-4-13)30-16-9-5-14(24-2)6-10-16/h3-12H,1H3,(H2,22,28)(H2,23,29)(H,25,26,27)/t12-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 410n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM186000
PNG
(US9163008, 89 | US9656968, Compound 89)
Show SMILES NC(=O)[C@@H]1CCCN1c1cc(nc(n1)-c1ccc(Oc2ccc(cc2)C#N)cc1)C(N)=O
Show InChI InChI=1S/C23H20N6O3/c24-13-14-3-7-16(8-4-14)32-17-9-5-15(6-10-17)23-27-18(21(25)30)12-20(28-23)29-11-1-2-19(29)22(26)31/h3-10,12,19H,1-2,11H2,(H2,25,30)(H2,26,31)/t19-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 410n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185912
PNG
(US9163008, 1 | US9656968, Compound 1)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C20H18FN5O3/c1-11(18(22)27)24-17-10-16(19(23)28)25-20(26-17)12-2-6-14(7-3-12)29-15-8-4-13(21)5-9-15/h2-11H,1H3,(H2,22,27)(H2,23,28)(H,24,25,26)/t11-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 420n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185919
PNG
(US9163008, 8 | US9656968, Compound 8)
Show SMILES NC(=O)c1cc(NC2(CC2)C(N)=O)nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1
Show InChI InChI=1S/C21H18FN5O3/c22-13-3-7-15(8-4-13)30-14-5-1-12(2-6-14)19-25-16(18(23)28)11-17(26-19)27-21(9-10-21)20(24)29/h1-8,11H,9-10H2,(H2,23,28)(H2,24,29)(H,25,26,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 420n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM186006
PNG
(US9163008, 95 | US9656968, Compound 95)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O)C(=O)N1CCOCC1
Show InChI InChI=1S/C24H24FN5O4/c1-15(24(32)30-10-12-33-13-11-30)27-21-14-20(22(26)31)28-23(29-21)16-2-6-18(7-3-16)34-19-8-4-17(25)5-9-19/h2-9,14-15H,10-13H2,1H3,(H2,26,31)(H,27,28,29)/t15-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 430n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185958
PNG
(US9163008, 47 | US9656968, Compound 47)
Show SMILES NC(=O)c1cc(NC(CO)CO)nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1
Show InChI InChI=1S/C20H19FN4O4/c21-13-3-7-16(8-4-13)29-15-5-1-12(2-6-15)20-24-17(19(22)28)9-18(25-20)23-14(10-26)11-27/h1-9,14,26-27H,10-11H2,(H2,22,28)(H,23,24,25)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 460n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185992
PNG
(US9163008, 81 | US9656968, Compound 81)
Show SMILES CN1CCN(C(C1)C(N)=O)c1cc(nc(n1)-c1ccc(Oc2ccc(cc2)C(F)(F)F)cc1)C(N)=O
Show InChI InChI=1S/C24H23F3N6O3/c1-32-10-11-33(19(13-32)22(29)35)20-12-18(21(28)34)30-23(31-20)14-2-6-16(7-3-14)36-17-8-4-15(5-9-17)24(25,26)27/h2-9,12,19H,10-11,13H2,1H3,(H2,28,34)(H2,29,35)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 490n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM186007
PNG
(US9163008, 96 | US9656968, Compound 96)
Show SMILES COC(=O)c1cc(ccc1Oc1ccc(F)cc1)-c1nc(N[C@@H](C)C(N)=O)cc(n1)C(N)=O
Show InChI InChI=1S/C22H20FN5O5/c1-11(19(24)29)26-18-10-16(20(25)30)27-21(28-18)12-3-8-17(15(9-12)22(31)32-2)33-14-6-4-13(23)5-7-14/h3-11H,1-2H3,(H2,24,29)(H2,25,30)(H,26,27,28)/t11-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 530n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM186001
PNG
(US9163008, 90 | US9656968, Compound 90)
Show SMILES NC(=O)[C@@H]1CCCN1c1cc(nc(n1)-c1ccc(Oc2ccc3OCOc3c2)cc1)C(N)=O
Show InChI InChI=1S/C23H21N5O5/c24-21(29)16-11-20(28-9-1-2-17(28)22(25)30)27-23(26-16)13-3-5-14(6-4-13)33-15-7-8-18-19(10-15)32-12-31-18/h3-8,10-11,17H,1-2,9,12H2,(H2,24,29)(H2,25,30)/t17-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 540n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185933
PNG
(US9163008, 22 | US9656968, Compound 22)
Show SMILES CC(Nc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C20H18FN5O3/c1-11(18(22)27)24-17-10-16(19(23)28)25-20(26-17)12-2-6-14(7-3-12)29-15-8-4-13(21)5-9-15/h2-11H,1H3,(H2,22,27)(H2,23,28)(H,24,25,26)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 550n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM186010
PNG
(US9163008, 99 | US9656968, Compound 99)
Show SMILES NC(=O)c1cc(N[C@H]2CCNC2=O)nc(n1)-c1ccc(Oc2ccc(cn2)C(F)(F)F)cc1
Show InChI InChI=1S/C21H17F3N6O3/c22-21(23,24)12-3-6-17(27-10-12)33-13-4-1-11(2-5-13)19-29-15(18(25)31)9-16(30-19)28-14-7-8-26-20(14)32/h1-6,9-10,14H,7-8H2,(H2,25,31)(H,26,32)(H,28,29,30)/t14-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 570n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185932
PNG
(US9163008, 21 | US9656968, Compound 21)
Show SMILES C[C@@H](Nc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C20H18FN5O3/c1-11(18(22)27)24-17-10-16(19(23)28)25-20(26-17)12-2-6-14(7-3-12)29-15-8-4-13(21)5-9-15/h2-11H,1H3,(H2,22,27)(H2,23,28)(H,24,25,26)/t11-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 600n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185922
PNG
(US9163008, 11 | US9656968, Compound 11)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2ccc(C#N)c(c2)C(F)(F)F)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C22H17F3N6O3/c1-11(19(27)32)29-18-9-17(20(28)33)30-21(31-18)12-2-5-14(6-3-12)34-15-7-4-13(10-26)16(8-15)22(23,24)25/h2-9,11H,1H3,(H2,27,32)(H2,28,33)(H,29,30,31)/t11-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 720n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185974
PNG
(US9163008, 63 | US9656968, Compound 63)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2ccc(Cl)cn2)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C19H17ClN6O3/c1-10(17(21)27)24-15-8-14(18(22)28)25-19(26-15)11-2-5-13(6-3-11)29-16-7-4-12(20)9-23-16/h2-10H,1H3,(H2,21,27)(H2,22,28)(H,24,25,26)/t10-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 790n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185926
PNG
(US9163008, 15 | US9656968, Compound 15)
Show SMILES COC(=O)[C@@H]1CCCN1c1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O
Show InChI InChI=1S/C23H21FN4O4/c1-31-23(30)19-3-2-12-28(19)20-13-18(21(25)29)26-22(27-20)14-4-8-16(9-5-14)32-17-10-6-15(24)7-11-17/h4-11,13,19H,2-3,12H2,1H3,(H2,25,29)/t19-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 860n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM186012
PNG
(US9163008, 101 | US9656968, Compound 101)
Show SMILES C[C@H](Nc1cc(nc(n1)N1CC(C1)Oc1ccc(OC(F)(F)F)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C18H19F3N6O4/c1-9(15(22)28)24-14-6-13(16(23)29)25-17(26-14)27-7-12(8-27)30-10-2-4-11(5-3-10)31-18(19,20)21/h2-6,9,12H,7-8H2,1H3,(H2,22,28)(H2,23,29)(H,24,25,26)/t9-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 870n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185950
PNG
(US9163008, 39 | US9656968, Compound 39)
Show SMILES COC(=O)[C@H](C)Nc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(=O)OC
Show InChI InChI=1S/C22H20FN3O5/c1-13(21(27)29-2)24-19-12-18(22(28)30-3)25-20(26-19)14-4-8-16(9-5-14)31-17-10-6-15(23)7-11-17/h4-13H,1-3H3,(H,24,25,26)/t13-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 950n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185944
PNG
(US9163008, 33 | US9656968, Compound 33)
Show SMILES COC(=O)[C@H](C)Nc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(O)=O
Show InChI InChI=1S/C21H18FN3O5/c1-12(21(28)29-2)23-18-11-17(20(26)27)24-19(25-18)13-3-7-15(8-4-13)30-16-9-5-14(22)6-10-16/h3-12H,1-2H3,(H,26,27)(H,23,24,25)/t12-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 970n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185924
PNG
(US9163008, 13 | US9656968, Compound 13)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2ccc(cn2)C(F)(F)F)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C20H17F3N6O3/c1-10(17(24)30)27-15-8-14(18(25)31)28-19(29-15)11-2-5-13(6-3-11)32-16-7-4-12(9-26-16)20(21,22)23/h2-10H,1H3,(H2,24,30)(H2,25,31)(H,27,28,29)/t10-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 990n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM186014
PNG
(US9163008, 103 | US9656968, Compound 103)
Show SMILES C[C@H](Nc1cc(nc(n1)C1=CCC(CC1)Oc1ccc(cc1)C(F)(F)F)C(N)=O)C(N)=O
Show InChI InChI=1S/C21H22F3N5O3/c1-11(18(25)30)27-17-10-16(19(26)31)28-20(29-17)12-2-6-14(7-3-12)32-15-8-4-13(5-9-15)21(22,23)24/h2,4-5,8-11,14H,3,6-7H2,1H3,(H2,25,30)(H2,26,31)(H,27,28,29)/t11-,14?/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 1.08E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185945
PNG
(US9163008, 34 | US9656968, Compound 34)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(=O)OC(C)(C)C)C(N)=O
Show InChI InChI=1S/C24H25FN4O4/c1-14(21(26)30)27-20-13-19(23(31)33-24(2,3)4)28-22(29-20)15-5-9-17(10-6-15)32-18-11-7-16(25)8-12-18/h5-14H,1-4H3,(H2,26,30)(H,27,28,29)/t14-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 1.15E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185999
PNG
(US9163008, 88 | US9656968, Compound 88)
Show SMILES NC(=O)[C@@H]1CCCN1c1cc(nc(n1)-c1ccc(Oc2ccc(cn2)C(F)(F)F)cc1)C(N)=O
Show InChI InChI=1S/C22H19F3N6O3/c23-22(24,25)13-5-8-18(28-11-13)34-14-6-3-12(4-7-14)21-29-15(19(26)32)10-17(30-21)31-9-1-2-16(31)20(27)33/h3-8,10-11,16H,1-2,9H2,(H2,26,32)(H2,27,33)/t16-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 1.18E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185969
PNG
(US9163008, 58 | US9656968, Compound 58)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2ncccc2C(F)(F)F)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C20H17F3N6O3/c1-10(16(24)30)27-15-9-14(17(25)31)28-18(29-15)11-4-6-12(7-5-11)32-19-13(20(21,22)23)3-2-8-26-19/h2-10H,1H3,(H2,24,30)(H2,25,31)(H,27,28,29)/t10-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 1.27E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185915
PNG
(US9163008, 4 | US9656968, Compound 4)
Show SMILES NC(=O)[C@H](CO)Nc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O
Show InChI InChI=1S/C20H18FN5O4/c21-12-3-7-14(8-4-12)30-13-5-1-11(2-6-13)20-25-15(18(22)28)9-17(26-20)24-16(10-27)19(23)29/h1-9,16,27H,10H2,(H2,22,28)(H2,23,29)(H,24,25,26)/t16-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 1.40E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185983
PNG
(US9163008, 72 | US9656968, Compound 72)
Show SMILES C[C@H](Nc1cc(nc(Oc2ccc(cc2-c2ccnnc2)C(F)(F)F)n1)C(N)=O)C(N)=O
Show InChI InChI=1S/C19H16F3N7O3/c1-9(16(23)30)27-15-7-13(17(24)31)28-18(29-15)32-14-3-2-11(19(20,21)22)6-12(14)10-4-5-25-26-8-10/h2-9H,1H3,(H2,23,30)(H2,24,31)(H,27,28,29)/t9-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 1.42E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM186005
PNG
(US9163008, 94 | US9656968, Compound 94)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O)C(=O)NCCO
Show InChI InChI=1S/C22H22FN5O4/c1-13(22(31)25-10-11-29)26-19-12-18(20(24)30)27-21(28-19)14-2-6-16(7-3-14)32-17-8-4-15(23)5-9-17/h2-9,12-13,29H,10-11H2,1H3,(H2,24,30)(H,25,31)(H,26,27,28)/t13-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 1.59E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185971
PNG
(US9163008, 60 | US9656968, Compound 60)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2ccc(nc2)C(F)(F)F)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C20H17F3N6O3/c1-10(17(24)30)27-16-8-14(18(25)31)28-19(29-16)11-2-4-12(5-3-11)32-13-6-7-15(26-9-13)20(21,22)23/h2-10H,1H3,(H2,24,30)(H2,25,31)(H,27,28,29)/t10-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 1.66E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185965
PNG
(US9163008, 54 | US9656968, Compound 54)
Show SMILES C[C@H](Nc1nc(cc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C20H18FN5O3/c1-11(18(22)27)24-20-25-16(10-17(26-20)19(23)28)12-2-6-14(7-3-12)29-15-8-4-13(21)5-9-15/h2-11H,1H3,(H2,22,27)(H2,23,28)(H,24,25,26)/t11-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 1.75E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM309602
PNG
((S)-6-((1-amino-1-oxopropan-2-yl)amino)-2-(1,3-dih...)
Show SMILES C[C@H](Nc1cc(nc(n1)N1CCC(CC1)C1Cc2ccccc2C1)C(N)=O)C(N)=O
Show InChI InChI=1S/C22H28N6O2/c1-13(20(23)29)25-19-12-18(21(24)30)26-22(27-19)28-8-6-14(7-9-28)17-10-15-4-2-3-5-16(15)11-17/h2-5,12-14,17H,6-11H2,1H3,(H2,23,29)(H2,24,30)(H,25,26,27)/t13-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 1.80E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185943
PNG
(US9163008, 32 | US9656968, Compound 32)
Show SMILES COC(=O)[C@H](C)Nc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(=O)OC(C)(C)C
Show InChI InChI=1S/C25H26FN3O5/c1-15(23(30)32-5)27-21-14-20(24(31)34-25(2,3)4)28-22(29-21)16-6-10-18(11-7-16)33-19-12-8-17(26)9-13-19/h6-15H,1-5H3,(H,27,28,29)/t15-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 2.00E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185970
PNG
(US9163008, 59 | US9656968, Compound 59)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2cccc(n2)C(F)(F)F)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C20H17F3N6O3/c1-10(17(24)30)26-15-9-13(18(25)31)27-19(29-15)11-5-7-12(8-6-11)32-16-4-2-3-14(28-16)20(21,22)23/h2-10H,1H3,(H2,24,30)(H2,25,31)(H,26,27,29)/t10-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 2.04E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185966
PNG
(US9163008, 55 | US9656968, Compound 55)
Show SMILES C[C@H](Nc1cc(nc(n1)C(N)=O)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O
Show InChI InChI=1S/C20H18FN5O3/c1-11(18(22)27)24-17-10-16(25-20(26-17)19(23)28)12-2-6-14(7-3-12)29-15-8-4-13(21)5-9-15/h2-11H,1H3,(H2,22,27)(H2,23,28)(H,24,25,26)/t11-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 2.09E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185973
PNG
(US9163008, 62 | US9656968, Compound 62)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2ccc(F)cn2)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C19H17FN6O3/c1-10(17(21)27)24-15-8-14(18(22)28)25-19(26-15)11-2-5-13(6-3-11)29-16-7-4-12(20)9-23-16/h2-10H,1H3,(H2,21,27)(H2,22,28)(H,24,25,26)/t10-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 2.98E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185968
PNG
(US9163008, 57 | US9656968, Compound 57)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2cc(ccn2)C(F)(F)F)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C20H17F3N6O3/c1-10(17(24)30)27-15-9-14(18(25)31)28-19(29-15)11-2-4-13(5-3-11)32-16-8-12(6-7-26-16)20(21,22)23/h2-10H,1H3,(H2,24,30)(H2,25,31)(H,27,28,29)/t10-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 3.25E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185981
PNG
(US9163008, 70 | US9656968, Compound 70)
Show SMILES C[C@H](Nc1cc(nc(n1)N1CCN(CC1)c1ccc(F)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C18H22FN7O2/c1-11(16(20)27)22-15-10-14(17(21)28)23-18(24-15)26-8-6-25(7-9-26)13-4-2-12(19)3-5-13/h2-5,10-11H,6-9H2,1H3,(H2,20,27)(H2,21,28)(H,22,23,24)/t11-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 3.76E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM309629
PNG
((S)-6-((1-amino-1-oxopropan-2-yl)amino)-2-(4-(4-cy...)
Show SMILES C[C@H](Nc1cc(nc(n1)N1CCC(CC1)Oc1ccc(cc1)C#N)C(N)=O)C(N)=O
Show InChI InChI=1S/C20H23N7O3/c1-12(18(22)28)24-17-10-16(19(23)29)25-20(26-17)27-8-6-15(7-9-27)30-14-4-2-13(11-21)3-5-14/h2-5,10,12,15H,6-9H2,1H3,(H2,22,28)(H2,23,29)(H,24,25,26)/t12-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 4.57E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM186008
PNG
(US9163008, 97 | US9656968, Compound 97)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)c(CO)c1)C(N)=O)C(N)=O
Show InChI InChI=1S/C21H20FN5O4/c1-11(19(23)29)25-18-9-16(20(24)30)26-21(27-18)12-2-7-17(13(8-12)10-28)31-15-5-3-14(22)4-6-15/h2-9,11,28H,10H2,1H3,(H2,23,29)(H2,24,30)(H,25,26,27)/t11-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 5.72E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185980
PNG
(US9163008, 69 | US9656968, Compound 69)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)nc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C19H17FN6O3/c1-10(17(21)27)24-15-8-14(18(22)28)25-19(26-15)11-2-7-16(23-9-11)29-13-5-3-12(20)4-6-13/h2-10H,1H3,(H2,21,27)(H2,22,28)(H,24,25,26)/t10-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 6.10E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185972
PNG
(US9163008, 61 | US9656968, Compound 61)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2cccc(F)n2)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C19H17FN6O3/c1-10(17(21)27)23-15-9-13(18(22)28)24-19(26-15)11-5-7-12(8-6-11)29-16-4-2-3-14(20)25-16/h2-10H,1H3,(H2,21,27)(H2,22,28)(H,23,24,26)/t10-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 6.46E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185935
PNG
(US9163008, 24 | US9656968, Compound 24)
Show SMILES NC(=O)C1CCCN(C1)c1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O
Show InChI InChI=1S/C23H22FN5O3/c24-16-5-9-18(10-6-16)32-17-7-3-14(4-8-17)23-27-19(22(26)31)12-20(28-23)29-11-1-2-15(13-29)21(25)30/h3-10,12,15H,1-2,11,13H2,(H2,25,30)(H2,26,31)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 1.50E+4n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185939
PNG
(US9163008, 28 | US9656968, Compound 28)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O)C(O)=O
Show InChI InChI=1S/C20H17FN4O4/c1-11(20(27)28)23-17-10-16(18(22)26)24-19(25-17)12-2-6-14(7-3-12)29-15-8-4-13(21)5-9-15/h2-11H,1H3,(H2,22,26)(H,27,28)(H,23,24,25)/t11-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 1.50E+4n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185948
PNG
(US9163008, 37 | US9656968, Compound 37)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2ccc(cn2)C#N)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C20H17N7O3/c1-11(18(22)28)25-16-8-15(19(23)29)26-20(27-16)13-3-5-14(6-4-13)30-17-7-2-12(9-21)10-24-17/h2-8,10-11H,1H3,(H2,22,28)(H2,23,29)(H,25,26,27)/t11-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 1.50E+4n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185962
PNG
(US9163008, 51 | US9656968, Compound 51)
Show SMILES NC(=O)c1cc(NC[C@H](O)C(O)=O)nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1
Show InChI InChI=1S/C20H17FN4O5/c21-12-3-7-14(8-4-12)30-13-5-1-11(2-6-13)19-24-15(18(22)27)9-17(25-19)23-10-16(26)20(28)29/h1-9,16,26H,10H2,(H2,22,27)(H,28,29)(H,23,24,25)/t16-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185930
PNG
(US9163008, 19 | US9656968, Compound 19)
Show SMILES NC(=O)CCNc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O
Show InChI InChI=1S/C20H18FN5O3/c21-13-3-7-15(8-4-13)29-14-5-1-12(2-6-14)20-25-16(19(23)28)11-18(26-20)24-10-9-17(22)27/h1-8,11H,9-10H2,(H2,22,27)(H2,23,28)(H,24,25,26)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185961
PNG
(US9163008, 50 | US9656968, Compound 50)
Show SMILES NC(=O)[C@@H](O)CNc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O
Show InChI InChI=1S/C20H18FN5O4/c21-12-3-7-14(8-4-12)30-13-5-1-11(2-6-13)20-25-15(18(22)28)9-17(26-20)24-10-16(27)19(23)29/h1-9,16,27H,10H2,(H2,22,28)(H2,23,29)(H,24,25,26)/t16-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185927
PNG
(US9163008, 16 | US9656968, Compound 16)
Show SMILES CCOC(=O)[C@@H]1Cc2ccccc2N1c1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O
Show InChI InChI=1S/C28H23FN4O4/c1-2-36-28(35)24-15-18-5-3-4-6-23(18)33(24)25-16-22(26(30)34)31-27(32-25)17-7-11-20(12-8-17)37-21-13-9-19(29)10-14-21/h3-14,16,24H,2,15H2,1H3,(H2,30,34)/t24-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185979
PNG
(US9163008, 68 | US9656968, Compound 68)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccnc(Oc2ccc(F)cc2)c1)C(N)=O)C(N)=O
Show InChI InChI=1S/C19H17FN6O3/c1-10(17(21)27)24-15-9-14(18(22)28)25-19(26-15)11-6-7-23-16(8-11)29-13-4-2-12(20)3-5-13/h2-10H,1H3,(H2,21,27)(H2,22,28)(H,24,25,26)/t10-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185940
PNG
(US9163008, 29 | US9656968, Compound 29)
Show SMILES OC(=O)[C@@H]1CCCN1c1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(O)=O
Show InChI InChI=1S/C22H18FN3O5/c23-14-5-9-16(10-6-14)31-15-7-3-13(4-8-15)20-24-17(21(27)28)12-19(25-20)26-11-1-2-18(26)22(29)30/h3-10,12,18H,1-2,11H2,(H,27,28)(H,29,30)/t18-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185978
PNG
(US9163008, 67 | US9656968, Compound 67)
Show SMILES C[C@H](Nc1cc(nc(Oc2ccc(Cl)cc2-c2ccnc(N)c2)n1)C(N)=O)C(N)=O
Show InChI InChI=1S/C19H18ClN7O3/c1-9(17(22)28)25-16-8-13(18(23)29)26-19(27-16)30-14-3-2-11(20)7-12(14)10-4-5-24-15(21)6-10/h2-9H,1H3,(H2,21,24)(H2,22,28)(H2,23,29)(H,25,26,27)/t9-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185941
PNG
(US9163008, 30 | US9656968, Compound 30)
Show SMILES NC(=O)c1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)N1CCC[C@H]1C(O)=O
Show InChI InChI=1S/C22H19FN4O4/c23-14-5-9-16(10-6-14)31-15-7-3-13(4-8-15)21-25-17(20(24)28)12-19(26-21)27-11-1-2-18(27)22(29)30/h3-10,12,18H,1-2,11H2,(H2,24,28)(H,29,30)/t18-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185942
PNG
(US9163008, 31 | US9656968, Compound 40)
Show SMILES NC(=O)c1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)N1[C@@H](Cc2ccccc12)C(O)=O
Show InChI InChI=1S/C26H19FN4O4/c27-17-7-11-19(12-8-17)35-18-9-5-15(6-10-18)25-29-20(24(28)32)14-23(30-25)31-21-4-2-1-3-16(21)13-22(31)26(33)34/h1-12,14,22H,13H2,(H2,28,32)(H,33,34)/t22-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185957
PNG
(US9163008, 46 | US9656968, Compound 46)
Show SMILES NC(=O)c1cc(NC[C@H](O)CO)nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1
Show InChI InChI=1S/C20H19FN4O4/c21-13-3-7-16(8-4-13)29-15-5-1-12(2-6-15)20-24-17(19(22)28)9-18(25-20)23-10-14(27)11-26/h1-9,14,26-27H,10-11H2,(H2,22,28)(H,23,24,25)/t14-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185976
PNG
(US9163008, 65 | US9656968, Compound 65)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(O)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C14H15N5O3/c1-7(12(15)21)17-11-6-10(13(16)22)18-14(19-11)8-2-4-9(20)5-3-8/h2-7,20H,1H3,(H2,15,21)(H2,16,22)(H,17,18,19)/t7-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185942
PNG
(US9163008, 31 | US9656968, Compound 40)
Show SMILES NC(=O)c1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)N1[C@@H](Cc2ccccc12)C(O)=O
Show InChI InChI=1S/C26H19FN4O4/c27-17-7-11-19(12-8-17)35-18-9-5-15(6-10-18)25-29-20(24(28)32)14-23(30-25)31-21-4-2-1-3-16(21)13-22(31)26(33)34/h1-12,14,22H,13H2,(H2,28,32)(H,33,34)/t22-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185982
PNG
(US9163008, 71 | US9656968, Compound 71)
Show SMILES C[C@H](Nc1cc(nc(n1)N1CCN(CC1)C(c1ccc(F)cc1)c1ccc(F)cc1)C(N)=O)C(N)=O
Show InChI InChI=1S/C25H27F2N7O2/c1-15(23(28)35)30-21-14-20(24(29)36)31-25(32-21)34-12-10-33(11-13-34)22(16-2-6-18(26)7-3-16)17-4-8-19(27)9-5-17/h2-9,14-15,22H,10-13H2,1H3,(H2,28,35)(H2,29,36)(H,30,31,32)/t15-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185946
PNG
(US9163008, 35 | US9656968, Compound 35)
Show SMILES C[C@H](Nc1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(O)=O)C(N)=O
Show InChI InChI=1S/C20H17FN4O4/c1-11(18(22)26)23-17-10-16(20(27)28)24-19(25-17)12-2-6-14(7-3-12)29-15-8-4-13(21)5-9-15/h2-11H,1H3,(H2,22,26)(H,27,28)(H,23,24,25)/t11-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM185947
PNG
(US9163008, 36 | US9656968, Compound 36)
Show SMILES NC(=O)[C@@H]1Cc2ccccc2N1c1cc(nc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(N)=O
Show InChI InChI=1S/C26H20FN5O3/c27-17-7-11-19(12-8-17)35-18-9-5-15(6-10-18)26-30-20(24(28)33)14-23(31-26)32-21-4-2-1-3-16(21)13-22(32)25(29)34/h1-12,14,22H,13H2,(H2,28,33)(H2,29,34)/t22-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a>2.00E+4n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Assay Buffer: The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL...


US Patent US9656968 (2017)

More data for this
Ligand-Target Pair
* indicates data uncertainty>20%