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Patent code US10590140

Compile Data Set for Download or QSAR

Found 785 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
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436666
PNG
(6-(3-(5-((4- (dimethylamino)-4-(3- hydroxyphenyl)p...)
Show SMILES CCNc1ncc2c(n1)N(C)CCN(c1cccc(c1)-c1nnc(CN3CCC(CC3)(N(C)C)c3cccc(O)c3)o1)C2=O
Show InChI InChI=1S/C32H39N9O3/c1-5-33-31-34-20-26-28(35-31)39(4)16-17-41(30(26)43)24-10-6-8-22(18-24)29-37-36-27(44-29)21-40-14-12-32(13-15-40,38(2)3)23-9-7-11-25(42)19-23/h6-11,18-20,42H,5,12-17,21H2,1-4H3,(H,33,34,35)
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<100n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436621
PNG
((S)-2-methoxy-9- methyl-6-(2-methyl- 4-(3-(methyla...)
Show SMILES CNCC[C@H](Oc1ccc(CN2CCN(C)c3nc(OC)ncc3C2=O)c(C)c1)c1cccs1
Show InChI InChI=1S/C25H31N5O3S/c1-17-14-19(33-21(9-10-26-2)22-6-5-13-34-22)8-7-18(17)16-30-12-11-29(3)23-20(24(30)31)15-27-25(28-23)32-4/h5-8,13-15,21,26H,9-12,16H2,1-4H3/t21-/m0/s1
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<100n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436625
PNG
((S)-6-(2-fluoro-4-(3- (methylamino)-1- (thiophen-2...)
Show SMILES CNCC[C@H](Oc1ccc(CN2CCN(C)c3nc(OC)ncc3C2=O)c(F)c1)c1cccs1
Show InChI InChI=1S/C24H28FN5O3S/c1-26-9-8-20(21-5-4-12-34-21)33-17-7-6-16(19(25)13-17)15-30-11-10-29(2)22-18(23(30)31)14-27-24(28-22)32-3/h4-7,12-14,20,26H,8-11,15H2,1-3H3/t20-/m0/s1
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<100n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Monoamine transporter


(Homo sapiens (Human))
BDBM436666
PNG
(6-(3-(5-((4- (dimethylamino)-4-(3- hydroxyphenyl)p...)
Show SMILES CCNc1ncc2c(n1)N(C)CCN(c1cccc(c1)-c1nnc(CN3CCC(CC3)(N(C)C)c3cccc(O)c3)o1)C2=O
Show InChI InChI=1S/C32H39N9O3/c1-5-33-31-34-20-26-28(35-31)39(4)16-17-41(30(26)43)24-10-6-8-22(18-24)29-37-36-27(44-29)21-40-14-12-32(13-15-40,38(2)3)23-9-7-11-25(42)19-23/h6-11,18-20,42H,5,12-17,21H2,1-4H3,(H,33,34,35)
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<100n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
NET: Human norepinephrine transporter (NET) enriched membranes (5 μg) were incubated with 5 nM of radiolabeled [3H]-Nisoxetin in assay buffer co...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436318
PNG
(2-(ethylamino)-9- methyl-6-(3-(5-methyl- 1,3,4-oxa...)
Show SMILES CCNc1ncc2c(n1)N(C)CCN(c1cccc(c1)-c1nnc(C)o1)C2=O
Show InChI InChI=1S/C19H21N7O2/c1-4-20-19-21-11-15-16(22-19)25(3)8-9-26(18(15)27)14-7-5-6-13(10-14)17-24-23-12(2)28-17/h5-7,10-11H,4,8-9H2,1-3H3,(H,20,21,22)
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<100n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436666
PNG
(6-(3-(5-((4- (dimethylamino)-4-(3- hydroxyphenyl)p...)
Show SMILES CCNc1ncc2c(n1)N(C)CCN(c1cccc(c1)-c1nnc(CN3CCC(CC3)(N(C)C)c3cccc(O)c3)o1)C2=O
Show InChI InChI=1S/C32H39N9O3/c1-5-33-31-34-20-26-28(35-31)39(4)16-17-41(30(26)43)24-10-6-8-22(18-24)29-37-36-27(44-29)21-40-14-12-32(13-15-40,38(2)3)23-9-7-11-25(42)19-23/h6-11,18-20,42H,5,12-17,21H2,1-4H3,(H,33,34,35)
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<100n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436574
PNG
((S)-2-(ethylamino)-9- methyl-6-(3-(3- (methylamino...)
Show SMILES CCNc1ncc2c(n1)N(C)CCN(c1cccc(O[C@@H](CCNC)c3ccsc3)c1)C2=O
Show InChI InChI=1S/C24H30N6O2S/c1-4-26-24-27-15-20-22(28-24)29(3)11-12-30(23(20)31)18-6-5-7-19(14-18)32-21(8-10-25-2)17-9-13-33-16-17/h5-7,9,13-16,21,25H,4,8,10-12H2,1-3H3,(H,26,27,28)/t21-/m0/s1
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436584
PNG
((R)-2,9-dimethyl-6-(3- ((3-(methylamino)-1- (thiop...)
Show SMILES CNCC[C@@H](OCc1cccc(c1)N1CCN(C)c2nc(C)ncc2C1=O)c1cccs1
Show InChI InChI=1S/C24H29N5O2S/c1-17-26-15-20-23(27-17)28(3)11-12-29(24(20)30)19-7-4-6-18(14-19)16-31-21(9-10-25-2)22-8-5-13-32-22/h4-8,13-15,21,25H,9-12,16H2,1-3H3/t21-/m1/s1
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Monoamine transporter


(Homo sapiens (Human))
BDBM436607
PNG
((S)-8-(ethylamino)-1- methyl-4-(4-(3- (methylamino...)
Show SMILES CCNc1cc2N(C)CCN(Cc3ccc(O[C@@H](CCNC)c4cccs4)cc3)C(=O)c2cn1
Show InChI InChI=1S/C26H33N5O2S/c1-4-28-25-16-22-21(17-29-25)26(32)31(14-13-30(22)3)18-19-7-9-20(10-8-19)33-23(11-12-27-2)24-6-5-15-34-24/h5-10,15-17,23,27H,4,11-14,18H2,1-3H3,(H,28,29)/t23-/m0/s1
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
NET: Human norepinephrine transporter (NET) enriched membranes (5 μg) were incubated with 5 nM of radiolabeled [3H]-Nisoxetin in assay buffer co...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Monoamine transporter


(Homo sapiens (Human))
BDBM436609
PNG
((S)-8-methoxy-1- methyl-4-(4-(3- (methylamino)-1- ...)
Show SMILES CNCC[C@H](Oc1ccc(CN2CCN(C)c3cc(OC)ncc3C2=O)cc1)c1cccs1
Show InChI InChI=1S/C25H30N4O3S/c1-26-11-10-22(23-5-4-14-33-23)32-19-8-6-18(7-9-19)17-29-13-12-28(2)21-15-24(31-3)27-16-20(21)25(29)30/h4-9,14-16,22,26H,10-13,17H2,1-3H3/t22-/m0/s1
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
NET: Human norepinephrine transporter (NET) enriched membranes (5 μg) were incubated with 5 nM of radiolabeled [3H]-Nisoxetin in assay buffer co...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436611
PNG
(2-methoxy-9-methyl- 6-(4-(3- (methylamino)-1- (thi...)
Show SMILES CNCCC(Oc1ccc(CN2CCN(C)c3nc(OC)ncc3C2=O)cc1)c1ccsc1
Show InChI InChI=1S/C24H29N5O3S/c1-25-10-8-21(18-9-13-33-16-18)32-19-6-4-17(5-7-19)15-29-12-11-28(2)22-20(23(29)30)14-26-24(27-22)31-3/h4-7,9,13-14,16,21,25H,8,10-12,15H2,1-3H3
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436626
PNG
((S)-2-methoxy-9- methyl-6-(4-(3- (methylamino)-1- ...)
Show SMILES CNCC[C@H](Oc1ccc(CN2CCN(C)c3nc(OC)ncc3C2=O)cc1)c1cccs1
Show InChI InChI=1S/C24H29N5O3S/c1-25-11-10-20(21-5-4-14-33-21)32-18-8-6-17(7-9-18)16-29-13-12-28(2)22-19(23(29)30)15-26-24(27-22)31-3/h4-9,14-15,20,25H,10-13,16H2,1-3H3/t20-/m0/s1
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Monoamine transporter


(Homo sapiens (Human))
BDBM436641
PNG
((S)-2-(ethylamino)-9- methyl-6-(4-(3- (methylamino...)
Show SMILES CCNc1ncc2c(n1)N(C)CCN(Cc1ccc(O[C@@H](CCNC)c3cccs3)cc1)C2=O
Show InChI InChI=1S/C25H32N6O2S/c1-4-27-25-28-16-20-23(29-25)30(3)13-14-31(24(20)32)17-18-7-9-19(10-8-18)33-21(11-12-26-2)22-6-5-15-34-22/h5-10,15-16,21,26H,4,11-14,17H2,1-3H3,(H,27,28,29)/t21-/m0/s1
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
NET: Human norepinephrine transporter (NET) enriched membranes (5 μg) were incubated with 5 nM of radiolabeled [3H]-Nisoxetin in assay buffer co...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436448
PNG
(2,9-dimethyl-6-(3-((3- (methylamino)-1- (thiophen-...)
Show SMILES CNCCC(OCc1cccc(c1)N1CCN(C)c2nc(C)ncc2C1=O)c1cccs1
Show InChI InChI=1S/C24H29N5O2S/c1-17-26-15-20-23(27-17)28(3)11-12-29(24(20)30)19-7-4-6-18(14-19)16-31-21(9-10-25-2)22-8-5-13-32-22/h4-8,13-15,21,25H,9-12,16H2,1-3H3
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436454
PNG
(8-(dimethylamino)-1- methyl-4-(3-(3- (methylamino)...)
Show SMILES CNCCC(Oc1cccc(c1)N1CCN(C)c2cc(ncc2C1=O)N(C)C)c1cccs1
Show InChI InChI=1S/C25H31N5O2S/c1-26-11-10-22(23-9-6-14-33-23)32-19-8-5-7-18(15-19)30-13-12-29(4)21-16-24(28(2)3)27-17-20(21)25(30)31/h5-9,14-17,22,26H,10-13H2,1-4H3
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Monoamine transporter


(Homo sapiens (Human))
BDBM436389
PNG
((R)-9-methyl-6-(3-((3- (methylamino)-1- phenylprop...)
Show SMILES CNCC[C@@H](OCc1cccc(c1)N1CCN(C)c2nc(SC)ncc2C1=O)c1ccccc1
Show InChI InChI=1S/C26H31N5O2S/c1-27-13-12-23(20-9-5-4-6-10-20)33-18-19-8-7-11-21(16-19)31-15-14-30(2)24-22(25(31)32)17-28-26(29-24)34-3/h4-11,16-17,23,27H,12-15,18H2,1-3H3/t23-/m1/s1
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
NET: Human norepinephrine transporter (NET) enriched membranes (5 μg) were incubated with 5 nM of radiolabeled [3H]-Nisoxetin in assay buffer co...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Monoamine transporter


(Homo sapiens (Human))
BDBM436407
PNG
(6-(3-(4- ((benzylamino)methyl)- 1H-1,2,3-triazol-1...)
Show SMILES CCNc1ncc2c(n1)N(C)CCN(c1cccc(c1)-n1cc(CNCc3ccccc3)nn1)C2=O
Show InChI InChI=1S/C26H29N9O/c1-3-28-26-29-17-23-24(30-26)33(2)12-13-34(25(23)36)21-10-7-11-22(14-21)35-18-20(31-32-35)16-27-15-19-8-5-4-6-9-19/h4-11,14,17-18,27H,3,12-13,15-16H2,1-2H3,(H,28,29,30)
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
NET: Human norepinephrine transporter (NET) enriched membranes (5 μg) were incubated with 5 nM of radiolabeled [3H]-Nisoxetin in assay buffer co...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436643
PNG
((S)-2-(dimethylamino)- 9-methyl-6-(4-(3- (methylam...)
Show SMILES CNCC[C@H](Oc1ccc(CN2CCN(C)c3nc(ncc3C2=O)N(C)C)cc1)c1cccs1
Show InChI InChI=1S/C25H32N6O2S/c1-26-12-11-21(22-6-5-15-34-22)33-19-9-7-18(8-10-19)17-31-14-13-30(4)23-20(24(31)32)16-27-25(28-23)29(2)3/h5-10,15-16,21,26H,11-14,17H2,1-4H3/t21-/m0/s1
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Monoamine transporter


(Homo sapiens (Human))
BDBM436659
PNG
(9-methyl-6-(4-(3- (methylamino)-1- (thiophen-2- yl...)
Show SMILES CNCCC(Oc1ccc(CN2CCN(C)c3ncncc3C2=O)cc1)c1cccs1
Show InChI InChI=1S/C23H27N5O2S/c1-24-10-9-20(21-4-3-13-31-21)30-18-7-5-17(6-8-18)15-28-12-11-27(2)22-19(23(28)29)14-25-16-26-22/h3-8,13-14,16,20,24H,9-12,15H2,1-2H3
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
NET: Human norepinephrine transporter (NET) enriched membranes (5 μg) were incubated with 5 nM of radiolabeled [3H]-Nisoxetin in assay buffer co...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436660
PNG
((S)-9-methyl-6-(4-(3- (methylamino)-1- (thiophen-2...)
Show SMILES CNCC[C@H](Oc1ccc(CN2CCN(C)c3ncncc3C2=O)cc1)c1cccs1
Show InChI InChI=1S/C23H27N5O2S/c1-24-10-9-20(21-4-3-13-31-21)30-18-7-5-17(6-8-18)15-28-12-11-27(2)22-19(23(28)29)14-25-16-26-22/h3-8,13-14,16,20,24H,9-12,15H2,1-2H3/t20-/m0/s1
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436480
PNG
(6-(3-(5- ((benzyl(methyl)amino) methyl)-1,3,4- oxa...)
Show SMILES CCNc1ncc2c(n1)N(C)CCN(c1cccc(c1)-c1nnc(CN(C)Cc3ccccc3)o1)C2=O
Show InChI InChI=1S/C27H30N8O2/c1-4-28-27-29-16-22-24(30-27)34(3)13-14-35(26(22)36)21-12-8-11-20(15-21)25-32-31-23(37-25)18-33(2)17-19-9-6-5-7-10-19/h5-12,15-16H,4,13-14,17-18H2,1-3H3,(H,28,29,30)
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436486
PNG
(2-(ethylamino)-9- methyl-6-(3-(1- phenethylpiperid...)
Show SMILES CCNc1ncc2c(n1)N(C)CCN(c1cccc(c1)C1CCN(CCc3ccccc3)CC1)C2=O
Show InChI InChI=1S/C29H36N6O/c1-3-30-29-31-21-26-27(32-29)33(2)18-19-35(28(26)36)25-11-7-10-24(20-25)23-13-16-34(17-14-23)15-12-22-8-5-4-6-9-22/h4-11,20-21,23H,3,12-19H2,1-2H3,(H,30,31,32)
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436495
PNG
(2-(ethylamino)-9- methyl-6-(3-(2- (methyl(phenethy...)
Show SMILES CCNc1ncc2c(n1)N(C)CCN(c1cccc(CCN(C)CCc3ccccc3)c1)C2=O
Show InChI InChI=1S/C27H34N6O/c1-4-28-27-29-20-24-25(30-27)32(3)17-18-33(26(24)34)23-12-8-11-22(19-23)14-16-31(2)15-13-21-9-6-5-7-10-21/h5-12,19-20H,4,13-18H2,1-3H3,(H,28,29,30)
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436500
PNG
(2-(ethylamino)-6-(3-(2-(4- (3-hydroxyphenyl) piper...)
Show SMILES CCNc1ncc2c(n1)N(C)CCN(c1cccc(CCN3CCC(CC3)c3cccc(O)c3)c1)C2=O
Show InChI InChI=1S/C29H36N6O2/c1-3-30-29-31-20-26-27(32-29)33(2)16-17-35(28(26)37)24-8-4-6-21(18-24)10-13-34-14-11-22(12-15-34)23-7-5-9-25(36)19-23/h4-9,18-20,22,36H,3,10-17H2,1-2H3,(H,30,31,32)
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436509
PNG
(6-(3-(4- (((cyclopropylmethyl) amino)methyl)-1H- 1...)
Show SMILES CCNc1ncc2c(n1)N(C)CCN(c1cccc(c1)-n1cc(CNCC3CC3)nn1)C2=O
Show InChI InChI=1S/C23H29N9O/c1-3-25-23-26-14-20-21(27-23)30(2)9-10-31(22(20)33)18-5-4-6-19(11-18)32-15-17(28-29-32)13-24-12-16-7-8-16/h4-6,11,14-16,24H,3,7-10,12-13H2,1-2H3,(H,25,26,27)
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436510
PNG
(2-(ethylamino)-6-(3-(4- ((ethylamino)methyl)- 1H-1...)
Show SMILES CCNCc1cn(nn1)-c1cccc(c1)N1CCN(C)c2nc(NCC)ncc2C1=O
Show InChI InChI=1S/C21H27N9O/c1-4-22-12-15-14-30(27-26-15)17-8-6-7-16(11-17)29-10-9-28(3)19-18(20(29)31)13-24-21(25-19)23-5-2/h6-8,11,13-14,22H,4-5,9-10,12H2,1-3H3,(H,23,24,25)
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Monoamine transporter


(Homo sapiens (Human))
BDBM436454
PNG
(8-(dimethylamino)-1- methyl-4-(3-(3- (methylamino)...)
Show SMILES CNCCC(Oc1cccc(c1)N1CCN(C)c2cc(ncc2C1=O)N(C)C)c1cccs1
Show InChI InChI=1S/C25H31N5O2S/c1-26-11-10-22(23-9-6-14-33-23)32-19-8-5-7-18(15-19)30-13-12-29(4)21-16-24(28(2)3)27-17-20(21)25(30)31/h5-9,14-17,22,26H,10-13H2,1-4H3
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
NET: Human norepinephrine transporter (NET) enriched membranes (5 μg) were incubated with 5 nM of radiolabeled [3H]-Nisoxetin in assay buffer co...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436517
PNG
(6-(3-(4-((4- (dimethylamino)-4-(3- hydroxyphenyl)p...)
Show SMILES CCNc1ncc2c(n1)N(C)CCN(c1cccc(c1)-n1cc(CN3CCC(CC3)(N(C)C)c3cccc(O)c3)nn1)C2=O
Show InChI InChI=1S/C32H40N10O2/c1-5-33-31-34-20-28-29(35-31)39(4)16-17-41(30(28)44)25-9-7-10-26(19-25)42-22-24(36-37-42)21-40-14-12-32(13-15-40,38(2)3)23-8-6-11-27(43)18-23/h6-11,18-20,22,43H,5,12-17,21H2,1-4H3,(H,33,34,35)
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436555
PNG
((S)-8-methoxy-1- methyl-4-(3-(3- (methylamino)-1- ...)
Show SMILES CNCC[C@H](Oc1cccc(c1)N1CCN(C)c2cc(OC)ncc2C1=O)c1cccs1
Show InChI InChI=1S/C24H28N4O3S/c1-25-10-9-21(22-8-5-13-32-22)31-18-7-4-6-17(14-18)28-12-11-27(2)20-15-23(30-3)26-16-19(20)24(28)29/h4-8,13-16,21,25H,9-12H2,1-3H3/t21-/m0/s1
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436481
PNG
(6-(3-(3- (benzyl(methyl)amino) propoxy)phenyl)-2- ...)
Show SMILES CCNc1ncc2c(n1)N(C)CCN(c1cccc(OCCCN(C)Cc3ccccc3)c1)C2=O
Show InChI InChI=1S/C27H34N6O2/c1-4-28-27-29-19-24-25(30-27)32(3)15-16-33(26(24)34)22-12-8-13-23(18-22)35-17-9-14-31(2)20-21-10-6-5-7-11-21/h5-8,10-13,18-19H,4,9,14-17,20H2,1-3H3,(H,28,29,30)
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436490
PNG
(2-(ethylamino)-9- methyl-6-(3-(2- (methyl(phenethy...)
Show SMILES CCNc1ncc2c(n1)N(C)CCN(c1cccc(OCCN(C)CCc3ccccc3)c1)C2=O
Show InChI InChI=1S/C27H34N6O2/c1-4-28-27-29-20-24-25(30-27)32(3)15-16-33(26(24)34)22-11-8-12-23(19-22)35-18-17-31(2)14-13-21-9-6-5-7-10-21/h5-12,19-20H,4,13-18H2,1-3H3,(H,28,29,30)
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Monoamine transporter


(Homo sapiens (Human))
BDBM436490
PNG
(2-(ethylamino)-9- methyl-6-(3-(2- (methyl(phenethy...)
Show SMILES CCNc1ncc2c(n1)N(C)CCN(c1cccc(OCCN(C)CCc3ccccc3)c1)C2=O
Show InChI InChI=1S/C27H34N6O2/c1-4-28-27-29-20-24-25(30-27)32(3)15-16-33(26(24)34)22-11-8-12-23(19-22)35-18-17-31(2)14-13-21-9-6-5-7-10-21/h5-12,19-20H,4,13-18H2,1-3H3,(H,28,29,30)
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
NET: Human norepinephrine transporter (NET) enriched membranes (5 μg) were incubated with 5 nM of radiolabeled [3H]-Nisoxetin in assay buffer co...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436500
PNG
(2-(ethylamino)-6-(3-(2-(4- (3-hydroxyphenyl) piper...)
Show SMILES CCNc1ncc2c(n1)N(C)CCN(c1cccc(CCN3CCC(CC3)c3cccc(O)c3)c1)C2=O
Show InChI InChI=1S/C29H36N6O2/c1-3-30-29-31-20-26-27(32-29)33(2)16-17-35(28(26)37)24-8-4-6-21(18-24)10-13-34-14-11-22(12-15-34)23-7-5-9-25(36)19-23/h4-9,18-20,22,36H,3,10-17H2,1-2H3,(H,30,31,32)
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436574
PNG
((S)-2-(ethylamino)-9- methyl-6-(3-(3- (methylamino...)
Show SMILES CCNc1ncc2c(n1)N(C)CCN(c1cccc(O[C@@H](CCNC)c3ccsc3)c1)C2=O
Show InChI InChI=1S/C24H30N6O2S/c1-4-26-24-27-15-20-22(28-24)29(3)11-12-30(23(20)31)18-6-5-7-19(14-18)32-21(8-10-25-2)17-9-13-33-16-17/h5-7,9,13-16,21,25H,4,8,10-12H2,1-3H3,(H,26,27,28)/t21-/m0/s1
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436584
PNG
((R)-2,9-dimethyl-6-(3- ((3-(methylamino)-1- (thiop...)
Show SMILES CNCC[C@@H](OCc1cccc(c1)N1CCN(C)c2nc(C)ncc2C1=O)c1cccs1
Show InChI InChI=1S/C24H29N5O2S/c1-17-26-15-20-23(27-17)28(3)11-12-29(24(20)30)19-7-4-6-18(14-19)16-31-21(9-10-25-2)22-8-5-13-32-22/h4-8,13-15,21,25H,9-12,16H2,1-3H3/t21-/m1/s1
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436513
PNG
(2-(ethylamino)-9- methyl-6-(3-(4- ((methyl(pyridin...)
Show SMILES CCNc1ncc2c(n1)N(C)CCN(c1cccc(c1)-n1cc(CN(C)Cc3cccnc3)nn1)C2=O
Show InChI InChI=1S/C26H30N10O/c1-4-28-26-29-15-23-24(30-26)34(3)11-12-35(25(23)37)21-8-5-9-22(13-21)36-18-20(31-32-36)17-33(2)16-19-7-6-10-27-14-19/h5-10,13-15,18H,4,11-12,16-17H2,1-3H3,(H,28,29,30)
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436547
PNG
(1-methyl-4-(3-(3- (methylamino)-1- (thiophen-2- yl...)
Show SMILES CNCCC(Oc1cccc(c1)N1CCN(C)c2ccncc2C1=O)c1cccs1
Show InChI InChI=1S/C23H26N4O2S/c1-24-10-9-21(22-7-4-14-30-22)29-18-6-3-5-17(15-18)27-13-12-26(2)20-8-11-25-16-19(20)23(27)28/h3-8,11,14-16,21,24H,9-10,12-13H2,1-2H3
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Monoamine transporter


(Homo sapiens (Human))
BDBM436565
PNG
((R)-9-methyl-2- (methyl(pyridin-2- ylmethyl)amino)...)
Show SMILES CNCC[C@@H](OCc1cccc(c1)N1CCN(C)c2nc(ncc2C1=O)N(C)Cc1ccccn1)c1ccccc1
Show InChI InChI=1S/C32H37N7O2/c1-33-17-15-29(25-11-5-4-6-12-25)41-23-24-10-9-14-27(20-24)39-19-18-37(2)30-28(31(39)40)21-35-32(36-30)38(3)22-26-13-7-8-16-34-26/h4-14,16,20-21,29,33H,15,17-19,22-23H2,1-3H3/t29-/m1/s1
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
NET: Human norepinephrine transporter (NET) enriched membranes (5 μg) were incubated with 5 nM of radiolabeled [3H]-Nisoxetin in assay buffer co...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436605
PNG
(1-methyl-4-(4-(3- (methylamino)-1- (thiophen-2- yl...)
Show SMILES CNCCC(Oc1ccc(CN2CCN(C)c3ccncc3C2=O)cc1)c1cccs1
Show InChI InChI=1S/C24H28N4O2S/c1-25-11-10-22(23-4-3-15-31-23)30-19-7-5-18(6-8-19)17-28-14-13-27(2)21-9-12-26-16-20(21)24(28)29/h3-9,12,15-16,22,25H,10-11,13-14,17H2,1-2H3
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436606
PNG
((S)-1-methyl-4-(4-(3- (methylamino)-1- (thiophen-2...)
Show SMILES CNCC[C@H](Oc1ccc(CN2CCN(C)c3ccncc3C2=O)cc1)c1cccs1
Show InChI InChI=1S/C24H28N4O2S/c1-25-11-10-22(23-4-3-15-31-23)30-19-7-5-18(6-8-19)17-28-14-13-27(2)21-9-12-26-16-20(21)24(28)29/h3-9,12,15-16,22,25H,10-11,13-14,17H2,1-2H3/t22-/m0/s1
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Monoamine transporter


(Homo sapiens (Human))
BDBM436584
PNG
((R)-2,9-dimethyl-6-(3- ((3-(methylamino)-1- (thiop...)
Show SMILES CNCC[C@@H](OCc1cccc(c1)N1CCN(C)c2nc(C)ncc2C1=O)c1cccs1
Show InChI InChI=1S/C24H29N5O2S/c1-17-26-15-20-23(27-17)28(3)11-12-29(24(20)30)19-7-4-6-18(14-19)16-31-21(9-10-25-2)22-8-5-13-32-22/h4-8,13-15,21,25H,9-12,16H2,1-3H3/t21-/m1/s1
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
NET: Human norepinephrine transporter (NET) enriched membranes (5 μg) were incubated with 5 nM of radiolabeled [3H]-Nisoxetin in assay buffer co...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Monoamine transporter


(Homo sapiens (Human))
BDBM436588
PNG
((S)-9-methyl-6-(3-(3- (methylamino)-1- (thiophen-2...)
Show SMILES CNCC[C@H](Oc1cccc(c1)N1CCN(C)c2ncncc2C1=O)c1cccs1
Show InChI InChI=1S/C22H25N5O2S/c1-23-9-8-19(20-7-4-12-30-20)29-17-6-3-5-16(13-17)27-11-10-26(2)21-18(22(27)28)14-24-15-25-21/h3-7,12-15,19,23H,8-11H2,1-2H3/t19-/m0/s1
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
NET: Human norepinephrine transporter (NET) enriched membranes (5 μg) were incubated with 5 nM of radiolabeled [3H]-Nisoxetin in assay buffer co...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436599
PNG
((S)-2-methoxy-9- methyl-6-(4-(3- (methylamino)-1- ...)
Show SMILES CNCC[C@H](Oc1ccc(CN2CCN(C)c3nc(OC)ncc3C2=O)cc1)c1ccccc1
Show InChI InChI=1S/C26H31N5O3/c1-27-14-13-23(20-7-5-4-6-8-20)34-21-11-9-19(10-12-21)18-31-16-15-30(2)24-22(25(31)32)17-28-26(29-24)33-3/h4-12,17,23,27H,13-16,18H2,1-3H3/t23-/m0/s1
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436394
PNG
(6-(3-(3- (benzylamino)propoxy) phenyl)-2- (ethylam...)
Show SMILES CCNc1ncc2c(n1)N(C)CCN(c1cccc(OCCCNCc3ccccc3)c1)C2=O
Show InChI InChI=1S/C26H32N6O2/c1-3-28-26-29-19-23-24(30-26)31(2)14-15-32(25(23)33)21-11-7-12-22(17-21)34-16-8-13-27-18-20-9-5-4-6-10-20/h4-7,9-12,17,19,27H,3,8,13-16,18H2,1-2H3,(H,28,29,30)
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436603
PNG
((S)-9-methyl-6-(4-(3- (methylamino)-1- (thiophen-2...)
Show SMILES CNCC[C@H](Oc1ccc(CN2CCN(C)c3nc(SC)ncc3C2=O)cc1)c1cccs1
Show InChI InChI=1S/C24H29N5O2S2/c1-25-11-10-20(21-5-4-14-33-21)31-18-8-6-17(7-9-18)16-29-13-12-28(2)22-19(23(29)30)15-26-24(27-22)32-3/h4-9,14-15,20,25H,10-13,16H2,1-3H3/t20-/m0/s1
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Monoamine transporter


(Homo sapiens (Human))
BDBM436613
PNG
((S)-1-ethyl-8- methoxy-4-(4-(3- (methylamino)-1- (...)
Show SMILES CCN1CCN(Cc2ccc(O[C@@H](CCNC)c3cccs3)cc2)C(=O)c2cnc(OC)cc12
Show InChI InChI=1S/C26H32N4O3S/c1-4-29-13-14-30(26(31)21-17-28-25(32-3)16-22(21)29)18-19-7-9-20(10-8-19)33-23(11-12-27-2)24-6-5-15-34-24/h5-10,15-17,23,27H,4,11-14,18H2,1-3H3/t23-/m0/s1
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
NET: Human norepinephrine transporter (NET) enriched membranes (5 μg) were incubated with 5 nM of radiolabeled [3H]-Nisoxetin in assay buffer co...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Monoamine transporter


(Homo sapiens (Human))
BDBM436616
PNG
(2-methoxy-9-methyl- 6-(4-(3- (methylamino)-1-(5- m...)
Show SMILES CNCCC(Oc1ccc(CN2CCN(C)c3nc(OC)ncc3C2=O)cc1)c1ccc(C)s1
Show InChI InChI=1S/C25H31N5O3S/c1-17-5-10-22(34-17)21(11-12-26-2)33-19-8-6-18(7-9-19)16-30-14-13-29(3)23-20(24(30)31)15-27-25(28-23)32-4/h5-10,15,21,26H,11-14,16H2,1-4H3
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
NET: Human norepinephrine transporter (NET) enriched membranes (5 μg) were incubated with 5 nM of radiolabeled [3H]-Nisoxetin in assay buffer co...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436437
PNG
((R)-2-(ethylamino)-9- methyl-6-(3-((3- (methylamin...)
Show SMILES CCNc1ncc2c(n1)N(C)CCN(c1cccc(CO[C@H](CCNC)c3cccs3)c1)C2=O
Show InChI InChI=1S/C25H32N6O2S/c1-4-27-25-28-16-20-23(29-25)30(3)12-13-31(24(20)32)19-8-5-7-18(15-19)17-33-21(10-11-26-2)22-9-6-14-34-22/h5-9,14-16,21,26H,4,10-13,17H2,1-3H3,(H,27,28,29)/t21-/m1/s1
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (aa 25-1103)


(Homo sapiens (Human))
BDBM436471
PNG
(6-(3-(4- (((cyclopropylmethyl) (methyl)amino)methy...)
Show SMILES CCNc1ncc2c(n1)N(C)CCN(c1cccc(c1)-n1cc(CN(C)CC3CC3)nn1)C2=O
Show InChI InChI=1S/C24H31N9O/c1-4-25-24-26-13-21-22(27-24)31(3)10-11-32(23(21)34)19-6-5-7-20(12-19)33-16-18(28-29-33)15-30(2)14-17-8-9-17/h5-7,12-13,16-17H,4,8-11,14-15H2,1-3H3,(H,25,26,27)
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
Monoamine transporter


(Homo sapiens (Human))
BDBM436643
PNG
((S)-2-(dimethylamino)- 9-methyl-6-(4-(3- (methylam...)
Show SMILES CNCC[C@H](Oc1ccc(CN2CCN(C)c3nc(ncc3C2=O)N(C)C)cc1)c1cccs1
Show InChI InChI=1S/C25H32N6O2S/c1-26-12-11-21(22-6-5-15-34-22)33-19-9-7-18(8-10-19)17-31-14-13-30(4)23-20(24(31)32)16-27-25(28-23)29(2)3/h5-10,15-16,21,26H,11-14,17H2,1-4H3/t21-/m0/s1
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300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
NET: Human norepinephrine transporter (NET) enriched membranes (5 μg) were incubated with 5 nM of radiolabeled [3H]-Nisoxetin in assay buffer co...


US Patent US10590140 (2020)


Article DOI: null
More data for this
Ligand-Target Pair
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* indicates data uncertainty>20%