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Compile Data Set for Download or QSAR

Found 117 hits with Last Name = 'vartanian' and Initial = 'mg'   
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 N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50080037
PNG
(Benzoic acid 4-((S)-2-{(S)-2-[(4-tert-butyl-benzyl...)
Show SMILES CC(C)C[C@H](N(C)Cc1ccc(cc1)C(C)(C)C)C(=O)N[C@@H](Cc1ccc(OC(=O)c2ccccc2)cc1)C(=O)NC(C)(C)C
Show InChI InChI=1S/C38H51N3O4/c1-26(2)23-33(41(9)25-28-15-19-30(20-16-28)37(3,4)5)35(43)39-32(34(42)40-38(6,7)8)24-27-17-21-31(22-18-27)45-36(44)29-13-11-10-12-14-29/h10-22,26,32-33H,23-25H2,1-9H3,(H,39,43)(H,40,42)/t32-,33-/m0/s1
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n/an/a 36n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of N-type calcium channels in IMR-32 human neuroblastoma cells


Bioorg Med Chem Lett 9: 2151-6 (1999)


BindingDB Entry DOI: 10.7270/Q2H70F02
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel alpha-2 delta subunit


(Sus scrofa)
BDBM50080153
PNG
((1-Aminomethyl-cyclohexyl)-acetic acid | 2-(1-(ami...)
Show SMILES NCC1(CC(O)=O)CCCCC1
Show InChI InChI=1S/C9H17NO2/c10-7-9(6-8(11)12)4-2-1-3-5-9/h1-7,10H2,(H,11,12)
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n/an/a 70n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Displacement of [3H]gabapentin from alpha-2delta calcium channel in pig brain membrane


Bioorg Med Chem Lett 16: 2333-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.05.016
BindingDB Entry DOI: 10.7270/Q2CV4JJZ
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Voltage-dependent calcium channel alpha-2 delta subunit


(Sus scrofa)
BDBM50164279
PNG
((S)-3-(aminomethyl)-5-methylhexanoic acid | (S)-3-...)
Show SMILES CC(C)C[C@H](CN)CC(O)=O |r|
Show InChI InChI=1S/C8H17NO2/c1-6(2)3-7(5-9)4-8(10)11/h6-7H,3-5,9H2,1-2H3,(H,10,11)/t7-/m0/s1
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n/an/a 73n/an/an/an/an/an/a



PGRD Michigan Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]gabapentin from alpha2delta calcium channel in pig brain membrane


Bioorg Med Chem Lett 16: 2329-32 (2006)


Article DOI: 10.1016/j.bmcl.2005.06.090
BindingDB Entry DOI: 10.7270/Q2M32V9C
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel alpha-2 delta subunit


(Sus scrofa)
BDBM50168499
PNG
((1-((1H-tetrazol-5-yl)methyl)cycloheptyl)methanami...)
Show SMILES NCC1(Cc2nnn[nH]2)CCCCCC1
Show InChI InChI=1S/C10H19N5/c11-8-10(5-3-1-2-4-6-10)7-9-12-14-15-13-9/h1-8,11H2,(H,12,13,14,15)
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n/an/a 100n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Displacement of [3H]gabapentin from alpha-2delta calcium channel in pig brain membrane


Bioorg Med Chem Lett 16: 2333-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.05.016
BindingDB Entry DOI: 10.7270/Q2CV4JJZ
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel alpha-2 delta subunit


(Sus scrofa)
BDBM50212317
PNG
((1-((1H-tetrazol-5-yl)methyl)cyclohexyl)methanamin...)
Show SMILES NCC1(Cc2nnn[nH]2)CCCCC1
Show InChI InChI=1S/C9H17N5/c10-7-9(4-2-1-3-5-9)6-8-11-13-14-12-8/h1-7,10H2,(H,11,12,13,14)
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n/an/a 108n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Displacement of [3H]gabapentin from alpha-2delta calcium channel in pig brain membrane


Bioorg Med Chem Lett 16: 2333-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.05.016
BindingDB Entry DOI: 10.7270/Q2CV4JJZ
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50080046
PNG
(Benzoic acid 4-((S)-2-{(S)-2-[(4-bromo-benzyl)-met...)
Show SMILES CC(C)C[C@H](N(C)Cc1ccc(Br)cc1)C(=O)N[C@@H](Cc1ccc(OC(=O)c2ccccc2)cc1)C(=O)NC(C)(C)C
Show InChI InChI=1S/C34H42BrN3O4/c1-23(2)20-30(38(6)22-25-12-16-27(35)17-13-25)32(40)36-29(31(39)37-34(3,4)5)21-24-14-18-28(19-15-24)42-33(41)26-10-8-7-9-11-26/h7-19,23,29-30H,20-22H2,1-6H3,(H,36,40)(H,37,39)/t29-,30-/m0/s1
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n/an/a 130n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of N-type calcium channels in IMR-32 human neuroblastoma cells


Bioorg Med Chem Lett 9: 2151-6 (1999)


BindingDB Entry DOI: 10.7270/Q2H70F02
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel alpha-2 delta subunit


(Sus scrofa)
BDBM50171790
PNG
((S)-3-(aminomethyl)-4-(furan-2-yl)butanoic acid | ...)
Show SMILES NC[C@H](CC(O)=O)Cc1ccco1
Show InChI InChI=1S/C9H13NO3/c10-6-7(5-9(11)12)4-8-2-1-3-13-8/h1-3,7H,4-6,10H2,(H,11,12)/t7-/m0/s1
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n/an/a 178n/an/an/an/an/an/a



PGRD Michigan Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]gabapentin from alpha2delta calcium channel in pig brain membrane


Bioorg Med Chem Lett 16: 2329-32 (2006)


Article DOI: 10.1016/j.bmcl.2005.06.090
BindingDB Entry DOI: 10.7270/Q2M32V9C
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50076117
PNG
(Benzoic acid 4-{(S)-2-tert-butylcarbamoyl-2-[(S)-2...)
Show SMILES CC(C)C[C@H](N(C)C1CCCCC1)C(=O)N[C@@H](Cc1ccc(OC(=O)c2ccccc2)cc1)C(=O)NC(C)(C)C
Show InChI InChI=1S/C33H47N3O4/c1-23(2)21-29(36(6)26-15-11-8-12-16-26)31(38)34-28(30(37)35-33(3,4)5)22-24-17-19-27(20-18-24)40-32(39)25-13-9-7-10-14-25/h7,9-10,13-14,17-20,23,26,28-29H,8,11-12,15-16,21-22H2,1-6H3,(H,34,38)(H,35,37)/t28-,29-/m0/s1
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Warner-Lambert Company

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against N-type calcium channel in the IMR-32 human neuroblastoma cells


Bioorg Med Chem Lett 9: 907-12 (1999)


BindingDB Entry DOI: 10.7270/Q2D799MZ
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50080035
PNG
(Benzoic acid 4-((S)-2-tert-butylcarbamoyl-2-{(S)-2...)
Show SMILES CC(C)C[C@H](N(C)Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1ccc(OC(=O)c2ccccc2)cc1)C(=O)NC(C)(C)C
Show InChI InChI=1S/C34H42ClN3O4/c1-23(2)20-30(38(6)22-25-12-16-27(35)17-13-25)32(40)36-29(31(39)37-34(3,4)5)21-24-14-18-28(19-15-24)42-33(41)26-10-8-7-9-11-26/h7-19,23,29-30H,20-22H2,1-6H3,(H,36,40)(H,37,39)/t29-,30-/m0/s1
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Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of N-type calcium channels in IMR-32 human neuroblastoma cells


Bioorg Med Chem Lett 9: 2151-6 (1999)


BindingDB Entry DOI: 10.7270/Q2H70F02
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50080041
PNG
(Benzoic acid 4-((S)-2-tert-butylcarbamoyl-2-{(S)-2...)
Show SMILES CC(C)C[C@H](N(C)Cc1ccc(cc1)N(C)C)C(=O)N[C@@H](Cc1ccc(OC(=O)c2ccccc2)cc1)C(=O)NC(C)(C)C
Show InChI InChI=1S/C36H48N4O4/c1-25(2)22-32(40(8)24-27-14-18-29(19-15-27)39(6)7)34(42)37-31(33(41)38-36(3,4)5)23-26-16-20-30(21-17-26)44-35(43)28-12-10-9-11-13-28/h9-21,25,31-32H,22-24H2,1-8H3,(H,37,42)(H,38,41)/t31-,32-/m0/s1
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Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of N-type calcium channels in IMR-32 human neuroblastoma cells


Bioorg Med Chem Lett 9: 2151-6 (1999)


BindingDB Entry DOI: 10.7270/Q2H70F02
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50076108
PNG
(Benzoic acid 4-{(S)-2-tert-butylcarbamoyl-2-[(S)-2...)
Show SMILES CCCCN(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(OC(=O)c2ccccc2)cc1)C(=O)NC(C)(C)C
Show InChI InChI=1S/C31H45N3O4/c1-8-9-19-34(7)27(20-22(2)3)29(36)32-26(28(35)33-31(4,5)6)21-23-15-17-25(18-16-23)38-30(37)24-13-11-10-12-14-24/h10-18,22,26-27H,8-9,19-21H2,1-7H3,(H,32,36)(H,33,35)/t26-,27-/m0/s1
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Warner-Lambert Company

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against N-type calcium channel in the IMR-32 human neuroblastoma cells


Bioorg Med Chem Lett 9: 907-12 (1999)


BindingDB Entry DOI: 10.7270/Q2D799MZ
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50076106
PNG
(Benzoic acid 4-((S)-2-{(S)-2-[(azepane-1-carbonyl)...)
Show SMILES CC(C)C[C@H](NC(=O)N1CCCCCC1)C(=O)N[C@@H](Cc1ccc(OC(=O)c2ccccc2)cc1)C(=O)OC(C)(C)C
Show InChI InChI=1S/C33H45N3O6/c1-23(2)21-27(35-32(40)36-19-11-6-7-12-20-36)29(37)34-28(31(39)42-33(3,4)5)22-24-15-17-26(18-16-24)41-30(38)25-13-9-8-10-14-25/h8-10,13-18,23,27-28H,6-7,11-12,19-22H2,1-5H3,(H,34,37)(H,35,40)/t27-,28-/m0/s1
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Warner-Lambert Company

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against N-type calcium channel in the IMR-32 human neuroblastoma cells


Bioorg Med Chem Lett 9: 907-12 (1999)


BindingDB Entry DOI: 10.7270/Q2D799MZ
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50076112
PNG
(Benzoic acid 4-((S)-2-tert-butylcarbamoyl-2-{(S)-4...)
Show SMILES CC(C)CCN(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(OC(=O)c2ccccc2)cc1)C(=O)NC(C)(C)C
Show InChI InChI=1S/C32H47N3O4/c1-22(2)18-19-35(8)28(20-23(3)4)30(37)33-27(29(36)34-32(5,6)7)21-24-14-16-26(17-15-24)39-31(38)25-12-10-9-11-13-25/h9-17,22-23,27-28H,18-21H2,1-8H3,(H,33,37)(H,34,36)/t27-,28-/m0/s1
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Warner-Lambert Company

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against N-type calcium channel in the IMR-32 human neuroblastoma cells


Bioorg Med Chem Lett 9: 907-12 (1999)


BindingDB Entry DOI: 10.7270/Q2D799MZ
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50080040
PNG
(Benzoic acid 4-{(S)-2-[(S)-2-(benzyl-methyl-amino)...)
Show SMILES CC(C)C[C@H](N(C)Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(OC(=O)c2ccccc2)cc1)C(=O)NC(C)(C)C
Show InChI InChI=1S/C34H43N3O4/c1-24(2)21-30(37(6)23-26-13-9-7-10-14-26)32(39)35-29(31(38)36-34(3,4)5)22-25-17-19-28(20-18-25)41-33(40)27-15-11-8-12-16-27/h7-20,24,29-30H,21-23H2,1-6H3,(H,35,39)(H,36,38)/t29-,30-/m0/s1
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Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of N-type calcium channels in IMR-32 human neuroblastoma cells


Bioorg Med Chem Lett 9: 2151-6 (1999)


BindingDB Entry DOI: 10.7270/Q2H70F02
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50030655
PNG
((9S)-3-hydroxy-9-methyl-6-nitro-7,8,9,10-tetrahydr...)
Show SMILES CN1CCc2c(C1)c1[nH]c(=O)c(=[OH+])[n-]c1cc2[N+]([O-])=O
Show InChI InChI=1S/C12H12N4O4/c1-15-3-2-6-7(5-15)10-8(4-9(6)16(19)20)13-11(17)12(18)14-10/h4H,2-3,5H2,1H3,(H2,13,14,17,18)
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Warner-Lambert Company

Curated by ChEMBL


Assay Description
Affinity for N-methyl-D-aspartate glutamate receptor 1 in rat brain synaptic membranes, using [3H]glycine as radioligand


J Med Chem 38: 3720-40 (1995)


BindingDB Entry DOI: 10.7270/Q2NK3FND
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50030655
PNG
((9S)-3-hydroxy-9-methyl-6-nitro-7,8,9,10-tetrahydr...)
Show SMILES CN1CCc2c(C1)c1[nH]c(=O)c(=[OH+])[n-]c1cc2[N+]([O-])=O
Show InChI InChI=1S/C12H12N4O4/c1-15-3-2-6-7(5-15)10-8(4-9(6)16(19)20)13-11(17)12(18)14-10/h4H,2-3,5H2,1H3,(H2,13,14,17,18)
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Warner-Lambert Company

Curated by ChEMBL


Assay Description
Affinity for N-methyl-D-aspartate glutamate receptor 1 in rat brain synaptic membranes, using [3H]glycine as radioligand


J Med Chem 38: 3720-40 (1995)


BindingDB Entry DOI: 10.7270/Q2NK3FND
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50076110
PNG
(Benzoic acid 4-{(S)-2-tert-butylcarbamoyl-2-[(S)-2...)
Show SMILES CC(C)C[C@H](N(C)CC(C)C)C(=O)N[C@@H](Cc1ccc(OC(=O)c2ccccc2)cc1)C(=O)NC(C)(C)C
Show InChI InChI=1S/C31H45N3O4/c1-21(2)18-27(34(8)20-22(3)4)29(36)32-26(28(35)33-31(5,6)7)19-23-14-16-25(17-15-23)38-30(37)24-12-10-9-11-13-24/h9-17,21-22,26-27H,18-20H2,1-8H3,(H,32,36)(H,33,35)/t26-,27-/m0/s1
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Warner-Lambert Company

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against N-type calcium channel in the IMR-32 human neuroblastoma cells


Bioorg Med Chem Lett 9: 907-12 (1999)


BindingDB Entry DOI: 10.7270/Q2D799MZ
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50076101
PNG
(Benzoic acid 4-((S)-2-tert-butylcarbamoyl-2-{(S)-2...)
Show SMILES CC(C)C[C@H](N(C)CCC(C)(C)C)C(=O)N[C@@H](Cc1ccc(OC(=O)c2ccccc2)cc1)C(=O)NC(C)(C)C
Show InChI InChI=1S/C33H49N3O4/c1-23(2)21-28(36(9)20-19-32(3,4)5)30(38)34-27(29(37)35-33(6,7)8)22-24-15-17-26(18-16-24)40-31(39)25-13-11-10-12-14-25/h10-18,23,27-28H,19-22H2,1-9H3,(H,34,38)(H,35,37)/t27-,28-/m0/s1
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Warner-Lambert Company

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against N-type calcium channel in the IMR-32 human neuroblastoma cells


Bioorg Med Chem Lett 9: 907-12 (1999)


BindingDB Entry DOI: 10.7270/Q2D799MZ
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel alpha-2 delta subunit


(Sus scrofa)
BDBM50171795
PNG
(3-(aminomethyl)-4-(furan-2-yl)butanoic acid | CHEM...)
Show SMILES NCC(CC(O)=O)Cc1ccco1
Show InChI InChI=1S/C9H13NO3/c10-6-7(5-9(11)12)4-8-2-1-3-13-8/h1-3,7H,4-6,10H2,(H,11,12)
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n/an/a 421n/an/an/an/an/an/a



PGRD Michigan Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]gabapentin from alpha2delta calcium channel in pig brain membrane


Bioorg Med Chem Lett 16: 2329-32 (2006)


Article DOI: 10.1016/j.bmcl.2005.06.090
BindingDB Entry DOI: 10.7270/Q2M32V9C
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50080036
PNG
(Benzoic acid 4-((S)-2-tert-butylcarbamoyl-2-{(S)-2...)
Show SMILES COc1ccc(CN(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccc(OC(=O)c3ccccc3)cc2)C(=O)NC(C)(C)C)cc1
Show InChI InChI=1S/C35H45N3O5/c1-24(2)21-31(38(6)23-26-15-17-28(42-7)18-16-26)33(40)36-30(32(39)37-35(3,4)5)22-25-13-19-29(20-14-25)43-34(41)27-11-9-8-10-12-27/h8-20,24,30-31H,21-23H2,1-7H3,(H,36,40)(H,37,39)/t30-,31-/m0/s1
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n/an/a 500n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of N-type calcium channels in IMR-32 human neuroblastoma cells


Bioorg Med Chem Lett 9: 2151-6 (1999)


BindingDB Entry DOI: 10.7270/Q2H70F02
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel alpha-2 delta subunit


(Sus scrofa)
BDBM50171794
PNG
(3-(aminomethyl)-4-(furan-3-yl)butanoic acid | CHEM...)
Show SMILES NCC(CC(O)=O)Cc1ccoc1
Show InChI InChI=1S/C9H13NO3/c10-5-8(4-9(11)12)3-7-1-2-13-6-7/h1-2,6,8H,3-5,10H2,(H,11,12)
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n/an/a 518n/an/an/an/an/an/a



PGRD Michigan Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]gabapentin from alpha2delta calcium channel in pig brain membrane


Bioorg Med Chem Lett 16: 2329-32 (2006)


Article DOI: 10.1016/j.bmcl.2005.06.090
BindingDB Entry DOI: 10.7270/Q2M32V9C
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50080034
PNG
(Benzoic acid 4-((S)-2-tert-butylcarbamoyl-2-{(S)-2...)
Show SMILES CC(C)C[C@H](N(C)Cc1ccccc1Cl)C(=O)N[C@@H](Cc1ccc(OC(=O)c2ccccc2)cc1)C(=O)NC(C)(C)C
Show InChI InChI=1S/C34H42ClN3O4/c1-23(2)20-30(38(6)22-26-14-10-11-15-28(26)35)32(40)36-29(31(39)37-34(3,4)5)21-24-16-18-27(19-17-24)42-33(41)25-12-8-7-9-13-25/h7-19,23,29-30H,20-22H2,1-6H3,(H,36,40)(H,37,39)/t29-,30-/m0/s1
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n/an/a 560n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of N-type calcium channels in IMR-32 human neuroblastoma cells


Bioorg Med Chem Lett 9: 2151-6 (1999)


BindingDB Entry DOI: 10.7270/Q2H70F02
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50076111
PNG
(Benzoic acid 4-((S)-2-{(S)-2-[(azepane-1-carbonyl)...)
Show SMILES CC(C)C[C@H](NC(=O)N1CCCCCC1)C(=O)N[C@@H](Cc1ccc(OC(=O)c2ccccc2)cc1)C(=O)NC(C)(C)C
Show InChI InChI=1S/C33H46N4O5/c1-23(2)21-27(35-32(41)37-19-11-6-7-12-20-37)29(38)34-28(30(39)36-33(3,4)5)22-24-15-17-26(18-16-24)42-31(40)25-13-9-8-10-14-25/h8-10,13-18,23,27-28H,6-7,11-12,19-22H2,1-5H3,(H,34,38)(H,35,41)(H,36,39)/t27-,28-/m0/s1
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n/an/a 590n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against N-type calcium channel in the IMR-32 human neuroblastoma cells


Bioorg Med Chem Lett 9: 907-12 (1999)


BindingDB Entry DOI: 10.7270/Q2D799MZ
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50030670
PNG
(6-Bromo-9-ethyl-1,4,7,8,9,10-hexahydro-pyrido[3,4-...)
Show SMILES CCN1CCc2c(Br)cc3[nH]c(=O)c(=O)[nH]c3c2C1
Show InChI InChI=1S/C13H14BrN3O2/c1-2-17-4-3-7-8(6-17)11-10(5-9(7)14)15-12(18)13(19)16-11/h5H,2-4,6H2,1H3,(H,15,18)(H,16,19)
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n/an/a 620n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Affinity for N-methyl-D-aspartate glutamate receptor 1 in rat brain synaptic membranes, using [3H]glycine as radioligand


J Med Chem 38: 3720-40 (1995)


BindingDB Entry DOI: 10.7270/Q2NK3FND
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50030670
PNG
(6-Bromo-9-ethyl-1,4,7,8,9,10-hexahydro-pyrido[3,4-...)
Show SMILES CCN1CCc2c(Br)cc3[nH]c(=O)c(=O)[nH]c3c2C1
Show InChI InChI=1S/C13H14BrN3O2/c1-2-17-4-3-7-8(6-17)11-10(5-9(7)14)15-12(18)13(19)16-11/h5H,2-4,6H2,1H3,(H,15,18)(H,16,19)
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n/an/a 620n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Affinity for N-methyl-D-aspartate glutamate receptor 1 in rat brain synaptic membranes, using [3H]glycine as radioligand


J Med Chem 38: 3720-40 (1995)


BindingDB Entry DOI: 10.7270/Q2NK3FND
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50076115
PNG
(Benzoic acid 4-{(S)-2-tert-butylcarbamoyl-2-[(S)-2...)
Show SMILES CC(C)C[C@H](N(C)CC1CCCCC1)C(=O)N[C@@H](Cc1ccc(OC(=O)c2ccccc2)cc1)C(=O)NC(C)(C)C
Show InChI InChI=1S/C34H49N3O4/c1-24(2)21-30(37(6)23-26-13-9-7-10-14-26)32(39)35-29(31(38)36-34(3,4)5)22-25-17-19-28(20-18-25)41-33(40)27-15-11-8-12-16-27/h8,11-12,15-20,24,26,29-30H,7,9-10,13-14,21-23H2,1-6H3,(H,35,39)(H,36,38)/t29-,30-/m0/s1
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n/an/a 680n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of N-type calcium channels in IMR-32 human neuroblastoma cells


Bioorg Med Chem Lett 9: 2151-6 (1999)


BindingDB Entry DOI: 10.7270/Q2H70F02
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50076115
PNG
(Benzoic acid 4-{(S)-2-tert-butylcarbamoyl-2-[(S)-2...)
Show SMILES CC(C)C[C@H](N(C)CC1CCCCC1)C(=O)N[C@@H](Cc1ccc(OC(=O)c2ccccc2)cc1)C(=O)NC(C)(C)C
Show InChI InChI=1S/C34H49N3O4/c1-24(2)21-30(37(6)23-26-13-9-7-10-14-26)32(39)35-29(31(38)36-34(3,4)5)22-25-17-19-28(20-18-25)41-33(40)27-15-11-8-12-16-27/h8,11-12,15-20,24,26,29-30H,7,9-10,13-14,21-23H2,1-6H3,(H,35,39)(H,36,38)/t29-,30-/m0/s1
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n/an/a 700n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against N-type calcium channel in the IMR-32 human neuroblastoma cells


Bioorg Med Chem Lett 9: 907-12 (1999)


BindingDB Entry DOI: 10.7270/Q2D799MZ
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel alpha-2 delta subunit


(Sus scrofa)
BDBM50171796
PNG
(3-(aminomethyl)-4-(thiophen-3-yl)butanoic acid | C...)
Show SMILES NCC(CC(O)=O)Cc1ccsc1
Show InChI InChI=1S/C9H13NO2S/c10-5-8(4-9(11)12)3-7-1-2-13-6-7/h1-2,6,8H,3-5,10H2,(H,11,12)
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n/an/a 832n/an/an/an/an/an/a



PGRD Michigan Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]gabapentin from alpha2delta calcium channel in pig brain membrane


Bioorg Med Chem Lett 16: 2329-32 (2006)


Article DOI: 10.1016/j.bmcl.2005.06.090
BindingDB Entry DOI: 10.7270/Q2M32V9C
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50030663
PNG
(9-(3-Methyl-butyl)-6-nitro-1,4,7,8,9,10-hexahydro-...)
Show SMILES CC(C)CCN1CCc2c(C1)c1[nH]c(=O)c(=[OH+])[n-]c1cc2[N+]([O-])=O
Show InChI InChI=1S/C16H20N4O4/c1-9(2)3-5-19-6-4-10-11(8-19)14-12(7-13(10)20(23)24)17-15(21)16(22)18-14/h7,9H,3-6,8H2,1-2H3,(H2,17,18,21,22)
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n/an/a 860n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Affinity for N-methyl-D-aspartate glutamate receptor 1 in rat brain synaptic membranes, using [3H]glycine as radioligand


J Med Chem 38: 3720-40 (1995)


BindingDB Entry DOI: 10.7270/Q2NK3FND
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50030663
PNG
(9-(3-Methyl-butyl)-6-nitro-1,4,7,8,9,10-hexahydro-...)
Show SMILES CC(C)CCN1CCc2c(C1)c1[nH]c(=O)c(=[OH+])[n-]c1cc2[N+]([O-])=O
Show InChI InChI=1S/C16H20N4O4/c1-9(2)3-5-19-6-4-10-11(8-19)14-12(7-13(10)20(23)24)17-15(21)16(22)18-14/h7,9H,3-6,8H2,1-2H3,(H2,17,18,21,22)
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n/an/a 860n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Affinity for N-methyl-D-aspartate glutamate receptor 1 in rat brain synaptic membranes, using [3H]glycine as radioligand


J Med Chem 38: 3720-40 (1995)


BindingDB Entry DOI: 10.7270/Q2NK3FND
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50030654
PNG
((9S)-3-hydroxy-9-isopropyl-6-nitro-7,8,9,10-tetrah...)
Show SMILES CC(C)N1CCc2c(cc3[n-]c(=[OH+])c(=O)[nH]c3c2C1)[N+]([O-])=O
Show InChI InChI=1S/C14H16N4O4/c1-7(2)17-4-3-8-9(6-17)12-10(5-11(8)18(21)22)15-13(19)14(20)16-12/h5,7H,3-4,6H2,1-2H3,(H2,15,16,19,20)
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n/an/a 930n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Affinity for N-methyl-D-aspartate glutamate receptor 1 in rat brain synaptic membranes, using [3H]glycine as radioligand


J Med Chem 38: 3720-40 (1995)


BindingDB Entry DOI: 10.7270/Q2NK3FND
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50030654
PNG
((9S)-3-hydroxy-9-isopropyl-6-nitro-7,8,9,10-tetrah...)
Show SMILES CC(C)N1CCc2c(cc3[n-]c(=[OH+])c(=O)[nH]c3c2C1)[N+]([O-])=O
Show InChI InChI=1S/C14H16N4O4/c1-7(2)17-4-3-8-9(6-17)12-10(5-11(8)18(21)22)15-13(19)14(20)16-12/h5,7H,3-4,6H2,1-2H3,(H2,15,16,19,20)
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n/an/a 930n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Affinity for N-methyl-D-aspartate glutamate receptor 1 in rat brain synaptic membranes, using [3H]glycine as radioligand


J Med Chem 38: 3720-40 (1995)


BindingDB Entry DOI: 10.7270/Q2NK3FND
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50030669
PNG
(9-sec-Butyl-6-nitro-1,4,7,8,9,10-hexahydro-pyrido[...)
Show SMILES CCC(C)N1CCc2c(C1)c1[nH]c(=O)c(=[OH+])[n-]c1cc2[N+]([O-])=O
Show InChI InChI=1S/C15H18N4O4/c1-3-8(2)18-5-4-9-10(7-18)13-11(6-12(9)19(22)23)16-14(20)15(21)17-13/h6,8H,3-5,7H2,1-2H3,(H2,16,17,20,21)
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n/an/a 930n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Affinity for N-methyl-D-aspartate glutamate receptor 1 in rat brain synaptic membranes, using [3H]glycine as radioligand


J Med Chem 38: 3720-40 (1995)


BindingDB Entry DOI: 10.7270/Q2NK3FND
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50030669
PNG
(9-sec-Butyl-6-nitro-1,4,7,8,9,10-hexahydro-pyrido[...)
Show SMILES CCC(C)N1CCc2c(C1)c1[nH]c(=O)c(=[OH+])[n-]c1cc2[N+]([O-])=O
Show InChI InChI=1S/C15H18N4O4/c1-3-8(2)18-5-4-9-10(7-18)13-11(6-12(9)19(22)23)16-14(20)15(21)17-13/h6,8H,3-5,7H2,1-2H3,(H2,16,17,20,21)
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n/an/a 930n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Affinity for N-methyl-D-aspartate glutamate receptor 1 in rat brain synaptic membranes, using [3H]glycine as radioligand


J Med Chem 38: 3720-40 (1995)


BindingDB Entry DOI: 10.7270/Q2NK3FND
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50080043
PNG
(Benzoic acid 4-((S)-2-tert-butylcarbamoyl-2-{(S)-2...)
Show SMILES CC(C)C[C@H](N(C)Cc1cccc(Cl)c1)C(=O)N[C@@H](Cc1ccc(OC(=O)c2ccccc2)cc1)C(=O)NC(C)(C)C
Show InChI InChI=1S/C34H42ClN3O4/c1-23(2)19-30(38(6)22-25-11-10-14-27(35)20-25)32(40)36-29(31(39)37-34(3,4)5)21-24-15-17-28(18-16-24)42-33(41)26-12-8-7-9-13-26/h7-18,20,23,29-30H,19,21-22H2,1-6H3,(H,36,40)(H,37,39)/t29-,30-/m0/s1
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n/an/a 1.00E+3n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of N-type calcium channels in IMR-32 human neuroblastoma cells


Bioorg Med Chem Lett 9: 2151-6 (1999)


BindingDB Entry DOI: 10.7270/Q2H70F02
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50030658
PNG
(6-Bromo-1,4,7,8,9,10-hexahydro-pyrido[3,4-f]quinox...)
Show SMILES Brc1cc2[nH]c(=O)c(=O)[nH]c2c2CNCCc12
Show InChI InChI=1S/C11H10BrN3O2/c12-7-3-8-9(15-11(17)10(16)14-8)6-4-13-2-1-5(6)7/h3,13H,1-2,4H2,(H,14,16)(H,15,17)
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n/an/a 1.00E+3n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Affinity for N-methyl-D-aspartate glutamate receptor 1 in rat brain synaptic membranes, using [3H]glycine as radioligand


J Med Chem 38: 3720-40 (1995)


BindingDB Entry DOI: 10.7270/Q2NK3FND
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50030658
PNG
(6-Bromo-1,4,7,8,9,10-hexahydro-pyrido[3,4-f]quinox...)
Show SMILES Brc1cc2[nH]c(=O)c(=O)[nH]c2c2CNCCc12
Show InChI InChI=1S/C11H10BrN3O2/c12-7-3-8-9(15-11(17)10(16)14-8)6-4-13-2-1-5(6)7/h3,13H,1-2,4H2,(H,14,16)(H,15,17)
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n/an/a 1.00E+3n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Affinity for N-methyl-D-aspartate glutamate receptor 1 in rat brain synaptic membranes, using [3H]glycine as radioligand


J Med Chem 38: 3720-40 (1995)


BindingDB Entry DOI: 10.7270/Q2NK3FND
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50080042
PNG
(Benzoic acid 4-((S)-2-tert-butylcarbamoyl-2-{(S)-2...)
Show SMILES CC(C)C[C@H](N(C)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(OC(=O)c2ccccc2)cc1)C(=O)NC(C)(C)C
Show InChI InChI=1S/C34H43N3O5/c1-23(2)20-30(37(6)22-25-12-16-27(38)17-13-25)32(40)35-29(31(39)36-34(3,4)5)21-24-14-18-28(19-15-24)42-33(41)26-10-8-7-9-11-26/h7-19,23,29-30,38H,20-22H2,1-6H3,(H,35,40)(H,36,39)/t29-,30-/m0/s1
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n/an/a 1.00E+3n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of N-type calcium channels in IMR-32 human neuroblastoma cells


Bioorg Med Chem Lett 9: 2151-6 (1999)


BindingDB Entry DOI: 10.7270/Q2H70F02
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50030636
PNG
(9-(2-Methyl-butyl)-6-nitro-1,4,7,8,9,10-hexahydro-...)
Show SMILES CCC(C)CN1CCc2c(C1)c1[nH]c(=O)c(=[OH+])[n-]c1cc2[N+]([O-])=O
Show InChI InChI=1S/C16H20N4O4/c1-3-9(2)7-19-5-4-10-11(8-19)14-12(6-13(10)20(23)24)17-15(21)16(22)18-14/h6,9H,3-5,7-8H2,1-2H3,(H2,17,18,21,22)
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n/an/a 1.30E+3n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Affinity for N-methyl-D-aspartate glutamate receptor 1 in rat brain synaptic membranes, using [3H]glycine as radioligand


J Med Chem 38: 3720-40 (1995)


BindingDB Entry DOI: 10.7270/Q2NK3FND
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50030641
PNG
(1,4,7,8,9,10-Hexahydro-pyrido[2,3-f]quinoxaline-2,...)
Show SMILES O=c1[nH]c2ccc3CCCNc3c2[nH]c1=O
Show InChI InChI=1S/C11H11N3O2/c15-10-11(16)14-9-7(13-10)4-3-6-2-1-5-12-8(6)9/h3-4,12H,1-2,5H2,(H,13,15)(H,14,16)
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n/an/a 1.30E+3n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Affinity for N-methyl-D-aspartate glutamate receptor 1 in rat brain synaptic membranes, using [3H]glycine as radioligand


J Med Chem 38: 3720-40 (1995)


BindingDB Entry DOI: 10.7270/Q2NK3FND
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50030636
PNG
(9-(2-Methyl-butyl)-6-nitro-1,4,7,8,9,10-hexahydro-...)
Show SMILES CCC(C)CN1CCc2c(C1)c1[nH]c(=O)c(=[OH+])[n-]c1cc2[N+]([O-])=O
Show InChI InChI=1S/C16H20N4O4/c1-3-9(2)7-19-5-4-10-11(8-19)14-12(6-13(10)20(23)24)17-15(21)16(22)18-14/h6,9H,3-5,7-8H2,1-2H3,(H2,17,18,21,22)
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n/an/a 1.30E+3n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Affinity for N-methyl-D-aspartate glutamate receptor 1 in rat brain synaptic membranes, using [3H]glycine as radioligand


J Med Chem 38: 3720-40 (1995)


BindingDB Entry DOI: 10.7270/Q2NK3FND
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50030641
PNG
(1,4,7,8,9,10-Hexahydro-pyrido[2,3-f]quinoxaline-2,...)
Show SMILES O=c1[nH]c2ccc3CCCNc3c2[nH]c1=O
Show InChI InChI=1S/C11H11N3O2/c15-10-11(16)14-9-7(13-10)4-3-6-2-1-5-12-8(6)9/h3-4,12H,1-2,5H2,(H,13,15)(H,14,16)
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n/an/a 1.30E+3n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Affinity for N-methyl-D-aspartate glutamate receptor 1 in rat brain synaptic membranes, using [3H]glycine as radioligand


J Med Chem 38: 3720-40 (1995)


BindingDB Entry DOI: 10.7270/Q2NK3FND
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50030638
PNG
(9-Methyl-2,3-dioxo-1,2,3,4,7,8,9,10-octahydro-pyri...)
Show SMILES CN1CCc2c(cc3[nH]c(=O)c(=O)[nH]c3c2C1)C#N
Show InChI InChI=1S/C13H12N4O2/c1-17-3-2-8-7(5-14)4-10-11(9(8)6-17)16-13(19)12(18)15-10/h4H,2-3,6H2,1H3,(H,15,18)(H,16,19)
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n/an/a 1.40E+3n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Affinity for N-methyl-D-aspartate glutamate receptor 1 in rat brain synaptic membranes, using [3H]glycine as radioligand


J Med Chem 38: 3720-40 (1995)


BindingDB Entry DOI: 10.7270/Q2NK3FND
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50076100
PNG
(Benzoic acid 4-[(S)-2-tert-butylcarbamoyl-2-((S)-4...)
Show SMILES CC(C)C[C@H](N1CCCCC1)C(=O)N[C@@H](Cc1ccc(OC(=O)c2ccccc2)cc1)C(=O)NC(C)(C)C
Show InChI InChI=1S/C31H43N3O4/c1-22(2)20-27(34-18-10-7-11-19-34)29(36)32-26(28(35)33-31(3,4)5)21-23-14-16-25(17-15-23)38-30(37)24-12-8-6-9-13-24/h6,8-9,12-17,22,26-27H,7,10-11,18-21H2,1-5H3,(H,32,36)(H,33,35)/t26-,27-/m0/s1
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n/an/a 1.40E+3n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against N-type calcium channel in the IMR-32 human neuroblastoma cells


Bioorg Med Chem Lett 9: 907-12 (1999)


BindingDB Entry DOI: 10.7270/Q2D799MZ
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50030632
PNG
((9S)-9-ethyl-3-hydroxy-6-nitro-7,8,9,10-tetrahydro...)
Show SMILES CCN1CCc2c(C1)c1[nH]c(=O)c(=[OH+])[n-]c1cc2[N+]([O-])=O
Show InChI InChI=1S/C13H14N4O4/c1-2-16-4-3-7-8(6-16)11-9(5-10(7)17(20)21)14-12(18)13(19)15-11/h5H,2-4,6H2,1H3,(H2,14,15,18,19)
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n/an/a 1.40E+3n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Affinity for N-methyl-D-aspartate glutamate receptor 1 in rat brain synaptic membranes, using [3H]glycine as radioligand


J Med Chem 38: 3720-40 (1995)


BindingDB Entry DOI: 10.7270/Q2NK3FND
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50030638
PNG
(9-Methyl-2,3-dioxo-1,2,3,4,7,8,9,10-octahydro-pyri...)
Show SMILES CN1CCc2c(cc3[nH]c(=O)c(=O)[nH]c3c2C1)C#N
Show InChI InChI=1S/C13H12N4O2/c1-17-3-2-8-7(5-14)4-10-11(9(8)6-17)16-13(19)12(18)15-10/h4H,2-3,6H2,1H3,(H,15,18)(H,16,19)
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n/an/a 1.40E+3n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Affinity for N-methyl-D-aspartate glutamate receptor 1 in rat brain synaptic membranes, using [3H]glycine as radioligand


J Med Chem 38: 3720-40 (1995)


BindingDB Entry DOI: 10.7270/Q2NK3FND
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50030632
PNG
((9S)-9-ethyl-3-hydroxy-6-nitro-7,8,9,10-tetrahydro...)
Show SMILES CCN1CCc2c(C1)c1[nH]c(=O)c(=[OH+])[n-]c1cc2[N+]([O-])=O
Show InChI InChI=1S/C13H14N4O4/c1-2-16-4-3-7-8(6-16)11-9(5-10(7)17(20)21)14-12(18)13(19)15-11/h5H,2-4,6H2,1H3,(H2,14,15,18,19)
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n/an/a 1.40E+3n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Affinity for N-methyl-D-aspartate glutamate receptor 1 in rat brain synaptic membranes, using [3H]glycine as radioligand


J Med Chem 38: 3720-40 (1995)


BindingDB Entry DOI: 10.7270/Q2NK3FND
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel alpha-2 delta subunit


(Sus scrofa)
BDBM50171792
PNG
((R)-3-(aminomethyl)-4-(furan-2-yl)butanoic acid | ...)
Show SMILES NC[C@@H](CC(O)=O)Cc1ccco1
Show InChI InChI=1S/C9H13NO3/c10-6-7(5-9(11)12)4-8-2-1-3-13-8/h1-3,7H,4-6,10H2,(H,11,12)/t7-/m1/s1
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n/an/a 1.46E+3n/an/an/an/an/an/a



PGRD Michigan Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]gabapentin from alpha2delta calcium channel in pig brain membrane


Bioorg Med Chem Lett 16: 2329-32 (2006)


Article DOI: 10.1016/j.bmcl.2005.06.090
BindingDB Entry DOI: 10.7270/Q2M32V9C
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50076114
PNG
(Benzoic acid 4-{(S)-2-tert-butylcarbamoyl-2-[(S)-2...)
Show SMILES CCC(C)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(OC(=O)c2ccccc2)cc1)C(=O)NC(C)(C)C
Show InChI InChI=1S/C31H45N3O4/c1-9-22(4)34(8)27(19-21(2)3)29(36)32-26(28(35)33-31(5,6)7)20-23-15-17-25(18-16-23)38-30(37)24-13-11-10-12-14-24/h10-18,21-22,26-27H,9,19-20H2,1-8H3,(H,32,36)(H,33,35)/t22?,26-,27-/m0/s1
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n/an/a 1.50E+3n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against N-type calcium channel in the IMR-32 human neuroblastoma cells


Bioorg Med Chem Lett 9: 907-12 (1999)


BindingDB Entry DOI: 10.7270/Q2D799MZ
More data for this
Ligand-Target Pair
Voltage-dependent calcium channel alpha-2 delta subunit


(Sus scrofa)
BDBM50168498
PNG
((S)-2-((1H-tetrazol-5-yl)methyl)-4-methylpentan-1-...)
Show SMILES CC(C)C[C@H](CN)Cc1nnn[nH]1
Show InChI InChI=1S/C8H17N5/c1-6(2)3-7(5-9)4-8-10-12-13-11-8/h6-7H,3-5,9H2,1-2H3,(H,10,11,12,13)/t7-/m0/s1
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n/an/a 1.59E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Displacement of [3H]gabapentin from alpha-2delta calcium channel in pig brain membrane


Bioorg Med Chem Lett 16: 2333-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.05.016
BindingDB Entry DOI: 10.7270/Q2CV4JJZ
More data for this
Ligand-Target Pair
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