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Compile Data Set for Download or QSAR

Found 91 hits with Last Name = 'saitou' and Initial = 'y'   
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 L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50101813
PNG
(CHEBI:31399 | Cilnidipine)
Show SMILES COCCOC(=O)C1=C(C)NC(C)=C(C1c1cccc(c1)[N+]([O-])=O)C(=O)OC\C=C\c1ccccc1 |c:7,12|
Show InChI InChI=1S/C27H28N2O7/c1-18-23(26(30)35-14-8-11-20-9-5-4-6-10-20)25(21-12-7-13-22(17-21)29(32)33)24(19(2)28-18)27(31)36-16-15-34-3/h4-13,17,25,28H,14-16H2,1-3H3/b11-8+
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n/an/a 1.10n/an/an/an/an/an/a



Ajinomoto Pharmaceuticals Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of Voltage-dependent L-type calcium channel in rat thoracic aorta ring


Bioorg Med Chem Lett 21: 3317-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.04.007
BindingDB Entry DOI: 10.7270/Q2N019CJ
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50101813
PNG
(CHEBI:31399 | Cilnidipine)
Show SMILES COCCOC(=O)C1=C(C)NC(C)=C(C1c1cccc(c1)[N+]([O-])=O)C(=O)OC\C=C\c1ccccc1 |c:7,12|
Show InChI InChI=1S/C27H28N2O7/c1-18-23(26(30)35-14-8-11-20-9-5-4-6-10-20)25(21-12-7-13-22(17-21)29(32)33)24(19(2)28-18)27(31)36-16-15-34-3/h4-13,17,25,28H,14-16H2,1-3H3/b11-8+
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Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against L-type calcium channel in SD rat thoracic aorta by Magnus method


Bioorg Med Chem Lett 16: 798-802 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.021
BindingDB Entry DOI: 10.7270/Q2NP276R
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50101813
PNG
(CHEBI:31399 | Cilnidipine)
Show SMILES COCCOC(=O)C1=C(C)NC(C)=C(C1c1cccc(c1)[N+]([O-])=O)C(=O)OC\C=C\c1ccccc1 |c:7,12|
Show InChI InChI=1S/C27H28N2O7/c1-18-23(26(30)35-14-8-11-20-9-5-4-6-10-20)25(21-12-7-13-22(17-21)29(32)33)24(19(2)28-18)27(31)36-16-15-34-3/h4-13,17,25,28H,14-16H2,1-3H3/b11-8+
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Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibition of voltage-dependent L-type calcium channel in rat thoracic aorta ring assessed as effect on high K+ induced contraction by Magnus method


Bioorg Med Chem Lett 18: 4813-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.096
BindingDB Entry DOI: 10.7270/Q208684R
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50475660
PNG
(CHEMBL201566)
Show SMILES C\C(CO\C(O)=C1\C(C(C(O)=O)=C(C)N=C1C)c1cccc(Cl)c1)=C/c1ccccc1 |c:14,t:11|
Show InChI InChI=1S/C25H24ClNO4/c1-15(12-18-8-5-4-6-9-18)14-31-25(30)22-17(3)27-16(2)21(24(28)29)23(22)19-10-7-11-20(26)13-19/h4-13,23,30H,14H2,1-3H3,(H,28,29)/b15-12+,25-22+
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Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against L-type calcium channel in SD rat thoracic aorta by Magnus method


Bioorg Med Chem Lett 16: 798-802 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.021
BindingDB Entry DOI: 10.7270/Q2NP276R
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50475658
PNG
(CHEMBL201984)
Show SMILES CC1=NC(C)=C(C(\C1=C(/O)OC\C=C\C1CCCCC1)c1cccc(Cl)c1)C(O)=O |c:4,t:1|
Show InChI InChI=1S/C24H28ClNO4/c1-15-20(23(27)28)22(18-11-6-12-19(25)14-18)21(16(2)26-15)24(29)30-13-7-10-17-8-4-3-5-9-17/h6-7,10-12,14,17,22,29H,3-5,8-9,13H2,1-2H3,(H,27,28)/b10-7+,24-21+
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n/an/a 3.70n/an/an/an/an/an/a



Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against L-type calcium channel in SD rat thoracic aorta by Magnus method


Bioorg Med Chem Lett 16: 798-802 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.021
BindingDB Entry DOI: 10.7270/Q2NP276R
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50475653
PNG
(CHEMBL382528)
Show SMILES CC1=NC(C)=C(C(\C1=C(/O)OC\C=C\c1ccc(Cl)cc1)c1cccc(Cl)c1)C(O)=O |c:4,t:1|
Show InChI InChI=1S/C24H21Cl2NO4/c1-14-20(23(28)29)22(17-6-3-7-19(26)13-17)21(15(2)27-14)24(30)31-12-4-5-16-8-10-18(25)11-9-16/h3-11,13,22,30H,12H2,1-2H3,(H,28,29)/b5-4+,24-21+
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Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against L-type calcium channel in SD rat thoracic aorta by Magnus method


Bioorg Med Chem Lett 16: 798-802 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.021
BindingDB Entry DOI: 10.7270/Q2NP276R
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50475650
PNG
(CHEMBL203041)
Show SMILES CC1=NC(C)=C(C(\C1=C(/O)OC\C=C\c1ccc(C)cc1)c1cccc(Cl)c1)C(O)=O |c:4,t:1|
Show InChI InChI=1S/C25H24ClNO4/c1-15-9-11-18(12-10-15)6-5-13-31-25(30)22-17(3)27-16(2)21(24(28)29)23(22)19-7-4-8-20(26)14-19/h4-12,14,23,30H,13H2,1-3H3,(H,28,29)/b6-5+,25-22+
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Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against L-type calcium channel in SD rat thoracic aorta by Magnus method


Bioorg Med Chem Lett 16: 798-802 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.021
BindingDB Entry DOI: 10.7270/Q2NP276R
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50479255
PNG
(CHEMBL453084)
Show SMILES CCC1=C(C(C(C(O)=O)=C(C)N1)c1cccc(Cl)c1)C(=O)OC\C=C\c1ccccc1 |t:2,8|
Show InChI InChI=1S/C25H24ClNO4/c1-3-20-23(25(30)31-14-8-11-17-9-5-4-6-10-17)22(18-12-7-13-19(26)15-18)21(24(28)29)16(2)27-20/h4-13,15,22,27H,3,14H2,1-2H3,(H,28,29)/b11-8+
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Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibition of voltage-dependent L-type calcium channel in rat thoracic aorta ring assessed as effect on high K+ induced contraction by Magnus method


Bioorg Med Chem Lett 18: 4813-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.096
BindingDB Entry DOI: 10.7270/Q208684R
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50475663
PNG
(CHEMBL202464)
Show SMILES CC1=NC(C)=C(C(\C1=C(/O)OC\C=C\c1ccccc1)c1ccccc1)C(O)=O |c:4,t:1|
Show InChI InChI=1S/C24H23NO4/c1-16-20(23(26)27)22(19-13-7-4-8-14-19)21(17(2)25-16)24(28)29-15-9-12-18-10-5-3-6-11-18/h3-14,22,28H,15H2,1-2H3,(H,26,27)/b12-9+,24-21+
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Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against L-type calcium channel in SD rat thoracic aorta by Magnus method


Bioorg Med Chem Lett 16: 798-802 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.021
BindingDB Entry DOI: 10.7270/Q2NP276R
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50475664
PNG
(CHEMBL369934)
Show SMILES CC1=NC(C)=C(C(\C1=C(/O)OC\C=C\c1ccccc1)c1cccc(Br)c1)C(O)=O |c:4,t:1|
Show InChI InChI=1S/C24H22BrNO4/c1-15-20(23(27)28)22(18-11-6-12-19(25)14-18)21(16(2)26-15)24(29)30-13-7-10-17-8-4-3-5-9-17/h3-12,14,22,29H,13H2,1-2H3,(H,27,28)/b10-7+,24-21+
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Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against L-type calcium channel in SD rat thoracic aorta by Magnus method


Bioorg Med Chem Lett 16: 798-802 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.021
BindingDB Entry DOI: 10.7270/Q2NP276R
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50475672
PNG
(CHEMBL201057)
Show SMILES CC1=NC(C)=C(C(\C1=C(/O)OC\C=C\c1ccccc1)c1cccc(I)c1)C(O)=O |c:4,t:1|
Show InChI InChI=1S/C24H22INO4/c1-15-20(23(27)28)22(18-11-6-12-19(25)14-18)21(16(2)26-15)24(29)30-13-7-10-17-8-4-3-5-9-17/h3-12,14,22,29H,13H2,1-2H3,(H,27,28)/b10-7+,24-21+
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Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against L-type calcium channel in SD rat thoracic aorta by Magnus method


Bioorg Med Chem Lett 16: 798-802 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.021
BindingDB Entry DOI: 10.7270/Q2NP276R
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50475662
PNG
(CHEMBL201860)
Show SMILES CC1=NC(C)=C(C(\C1=C(/O)OCc1ccc2ccccc2c1)c1cccc(Cl)c1)C(O)=O |c:4,t:1|
Show InChI InChI=1S/C26H22ClNO4/c1-15-22(25(29)30)24(20-8-5-9-21(27)13-20)23(16(2)28-15)26(31)32-14-17-10-11-18-6-3-4-7-19(18)12-17/h3-13,24,31H,14H2,1-2H3,(H,29,30)/b26-23+
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n/an/a 14n/an/an/an/an/an/a



Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against L-type calcium channel in SD rat thoracic aorta by Magnus method


Bioorg Med Chem Lett 16: 798-802 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.021
BindingDB Entry DOI: 10.7270/Q2NP276R
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50475656
PNG
(CHEMBL201306)
Show SMILES CC1=NC(C)=C(C(\C1=C(/O)OC\C=C\c1ccccc1)c1cccc(F)c1)C(O)=O |c:4,t:1|
Show InChI InChI=1S/C24H22FNO4/c1-15-20(23(27)28)22(18-11-6-12-19(25)14-18)21(16(2)26-15)24(29)30-13-7-10-17-8-4-3-5-9-17/h3-12,14,22,29H,13H2,1-2H3,(H,27,28)/b10-7+,24-21+
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Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against L-type calcium channel in SD rat thoracic aorta by Magnus method


Bioorg Med Chem Lett 16: 798-802 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.021
BindingDB Entry DOI: 10.7270/Q2NP276R
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50475669
PNG
(CHEMBL382072)
Show SMILES CC1=NC(C)=C(C(\C1=C(/O)OC\C=C\c1ccccc1)c1cccc(Cl)c1)C(O)=O |c:4,t:1|
Show InChI InChI=1S/C24H22ClNO4/c1-15-20(23(27)28)22(18-11-6-12-19(25)14-18)21(16(2)26-15)24(29)30-13-7-10-17-8-4-3-5-9-17/h3-12,14,22,29H,13H2,1-2H3,(H,27,28)/b10-7+,24-21+
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Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against L-type calcium channel in SD rat thoracic aorta by Magnus method


Bioorg Med Chem Lett 16: 798-802 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.021
BindingDB Entry DOI: 10.7270/Q2NP276R
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50475669
PNG
(CHEMBL382072)
Show SMILES CC1=NC(C)=C(C(\C1=C(/O)OC\C=C\c1ccccc1)c1cccc(Cl)c1)C(O)=O |c:4,t:1|
Show InChI InChI=1S/C24H22ClNO4/c1-15-20(23(27)28)22(18-11-6-12-19(25)14-18)21(16(2)26-15)24(29)30-13-7-10-17-8-4-3-5-9-17/h3-12,14,22,29H,13H2,1-2H3,(H,27,28)/b10-7+,24-21+
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Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibition of voltage-dependent L-type calcium channel in rat thoracic aorta ring assessed as effect on high K+ induced contraction by Magnus method


Bioorg Med Chem Lett 18: 4813-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.096
BindingDB Entry DOI: 10.7270/Q208684R
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50475661
PNG
(CHEMBL204486)
Show SMILES CC1=NC(C)=C(C(\C1=C(/O)OC\C=C\c1ccccc1)c1ccccc1[N+]([O-])=O)C(O)=O |c:4,t:1|
Show InChI InChI=1S/C24H22N2O6/c1-15-20(23(27)28)22(18-12-6-7-13-19(18)26(30)31)21(16(2)25-15)24(29)32-14-8-11-17-9-4-3-5-10-17/h3-13,22,29H,14H2,1-2H3,(H,27,28)/b11-8+,24-21+
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n/an/a 31n/an/an/an/an/an/a



Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against L-type calcium channel in SD rat thoracic aorta by Magnus method


Bioorg Med Chem Lett 16: 798-802 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.021
BindingDB Entry DOI: 10.7270/Q2NP276R
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50475671
PNG
(CHEMBL382236)
Show SMILES CC1=NC(C)=C(C(c2ccsc2)\C1=C(/O)OC\C=C\c1ccccc1)C(O)=O |c:4,t:1|
Show InChI InChI=1S/C22H21NO4S/c1-14-18(21(24)25)20(17-10-12-28-13-17)19(15(2)23-14)22(26)27-11-6-9-16-7-4-3-5-8-16/h3-10,12-13,20,26H,11H2,1-2H3,(H,24,25)/b9-6+,22-19+
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n/an/a 44n/an/an/an/an/an/a



Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against L-type calcium channel in SD rat thoracic aorta by Magnus method


Bioorg Med Chem Lett 16: 798-802 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.021
BindingDB Entry DOI: 10.7270/Q2NP276R
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50475659
PNG
(CHEMBL508181)
Show SMILES CC1=C(C(C(C(=O)OC\C=C\c2ccccc2)=C(C)N1)c1cccc(c1)[N+]([O-])=O)C(O)=O |t:1,17|
Show InChI InChI=1S/C24H22N2O6/c1-15-20(23(27)28)22(18-11-6-12-19(14-18)26(30)31)21(16(2)25-15)24(29)32-13-7-10-17-8-4-3-5-9-17/h3-12,14,22,25H,13H2,1-2H3,(H,27,28)/b10-7+
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n/an/a 46n/an/an/an/an/an/a



Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against L-type calcium channel in SD rat thoracic aorta by Magnus method


Bioorg Med Chem Lett 16: 798-802 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.021
BindingDB Entry DOI: 10.7270/Q2NP276R
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50475659
PNG
(CHEMBL508181)
Show SMILES CC1=C(C(C(C(=O)OC\C=C\c2ccccc2)=C(C)N1)c1cccc(c1)[N+]([O-])=O)C(O)=O |t:1,17|
Show InChI InChI=1S/C24H22N2O6/c1-15-20(23(27)28)22(18-11-6-12-19(14-18)26(30)31)21(16(2)25-15)24(29)32-13-7-10-17-8-4-3-5-9-17/h3-12,14,22,25H,13H2,1-2H3,(H,27,28)/b10-7+
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n/an/a 46n/an/an/an/an/an/a



Ajinomoto Pharmaceuticals Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of Voltage-dependent L-type calcium channel in rat thoracic aorta ring


Bioorg Med Chem Lett 21: 3317-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.04.007
BindingDB Entry DOI: 10.7270/Q2N019CJ
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50475659
PNG
(CHEMBL508181)
Show SMILES CC1=C(C(C(C(=O)OC\C=C\c2ccccc2)=C(C)N1)c1cccc(c1)[N+]([O-])=O)C(O)=O |t:1,17|
Show InChI InChI=1S/C24H22N2O6/c1-15-20(23(27)28)22(18-11-6-12-19(14-18)26(30)31)21(16(2)25-15)24(29)32-13-7-10-17-8-4-3-5-9-17/h3-12,14,22,25H,13H2,1-2H3,(H,27,28)/b10-7+
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n/an/a 46n/an/an/an/an/an/a



Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibition of voltage-dependent L-type calcium channel in rat thoracic aorta ring assessed as effect on high K+ induced contraction by Magnus method


Bioorg Med Chem Lett 18: 4813-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.096
BindingDB Entry DOI: 10.7270/Q208684R
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50475648
PNG
(CHEMBL202605)
Show SMILES CC1=NC(C)=C(C(\C1=C(/O)OCC(=O)Nc1ccccc1)c1cccc(Cl)c1)C(O)=O |c:4,t:1|
Show InChI InChI=1S/C23H21ClN2O5/c1-13-19(22(28)29)21(15-7-6-8-16(24)11-15)20(14(2)25-13)23(30)31-12-18(27)26-17-9-4-3-5-10-17/h3-11,21,30H,12H2,1-2H3,(H,26,27)(H,28,29)/b23-20+
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n/an/a 50n/an/an/an/an/an/a



Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against L-type calcium channel in SD rat thoracic aorta by Magnus method


Bioorg Med Chem Lett 16: 798-802 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.021
BindingDB Entry DOI: 10.7270/Q2NP276R
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50475668
PNG
(CHEMBL202374)
Show SMILES CC1=NC(C)=C(C(\C1=C(/O)OC\C=C\c1ccccc1)c1cccc(C)c1)C(O)=O |c:4,t:1|
Show InChI InChI=1S/C25H25NO4/c1-16-9-7-13-20(15-16)23-21(24(27)28)17(2)26-18(3)22(23)25(29)30-14-8-12-19-10-5-4-6-11-19/h4-13,15,23,29H,14H2,1-3H3,(H,27,28)/b12-8+,25-22+
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n/an/a 76n/an/an/an/an/an/a



Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against L-type calcium channel in SD rat thoracic aorta by Magnus method


Bioorg Med Chem Lett 16: 798-802 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.021
BindingDB Entry DOI: 10.7270/Q2NP276R
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50475667
PNG
(CHEMBL382629)
Show SMILES CC1=NC(C)=C(C(c2ccoc2)\C1=C(/O)OC\C=C\c1ccccc1)C(O)=O |c:4,t:1|
Show InChI InChI=1S/C22H21NO5/c1-14-18(21(24)25)20(17-10-12-27-13-17)19(15(2)23-14)22(26)28-11-6-9-16-7-4-3-5-8-16/h3-10,12-13,20,26H,11H2,1-2H3,(H,24,25)/b9-6+,22-19+
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n/an/a 130n/an/an/an/an/an/a



Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against L-type calcium channel in SD rat thoracic aorta by Magnus method


Bioorg Med Chem Lett 16: 798-802 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.021
BindingDB Entry DOI: 10.7270/Q2NP276R
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50475649
PNG
(CHEMBL203470)
Show SMILES CC1=NC(C)=C(C(\C1=C(/O)OC\C=C\c1ccccc1)c1cccnc1)C(O)=O |c:4,t:1|
Show InChI InChI=1S/C23H22N2O4/c1-15-19(22(26)27)21(18-11-6-12-24-14-18)20(16(2)25-15)23(28)29-13-7-10-17-8-4-3-5-9-17/h3-12,14,21,28H,13H2,1-2H3,(H,26,27)/b10-7+,23-20+
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n/an/a 190n/an/an/an/an/an/a



Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against L-type calcium channel in SD rat thoracic aorta by Magnus method


Bioorg Med Chem Lett 16: 798-802 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.021
BindingDB Entry DOI: 10.7270/Q2NP276R
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50475670
PNG
(CHEMBL372748)
Show SMILES [#6]-[#6]1=[#7]-[#6](-[#6])=[#6](-[#6](\[#6]-1=[#6](/[#8])-[#8]-[#6]\[#6]=[#6](/c1ccccc1)-c1ccccc1)-c1cccc(Cl)c1)-[#6](-[#8])=O |c:4,t:1|
Show InChI InChI=1S/C30H26ClNO4/c1-19-26(29(33)34)28(23-14-9-15-24(31)18-23)27(20(2)32-19)30(35)36-17-16-25(21-10-5-3-6-11-21)22-12-7-4-8-13-22/h3-16,18,28,35H,17H2,1-2H3,(H,33,34)/b30-27+
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n/an/a 200n/an/an/an/an/an/a



Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against L-type calcium channel in SD rat thoracic aorta by Magnus method


Bioorg Med Chem Lett 16: 798-802 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.021
BindingDB Entry DOI: 10.7270/Q2NP276R
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50475655
PNG
(CHEMBL202459)
Show SMILES CC1=NC(C)=C(C(\C1=C(/O)OC\C=C\c1ccncc1)c1cccc(Cl)c1)C(O)=O |c:4,t:1|
Show InChI InChI=1S/C23H21ClN2O4/c1-14-19(22(27)28)21(17-6-3-7-18(24)13-17)20(15(2)26-14)23(29)30-12-4-5-16-8-10-25-11-9-16/h3-11,13,21,29H,12H2,1-2H3,(H,27,28)/b5-4+,23-20+
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n/an/a 320n/an/an/an/an/an/a



Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against L-type calcium channel in SD rat thoracic aorta by Magnus method


Bioorg Med Chem Lett 16: 798-802 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.021
BindingDB Entry DOI: 10.7270/Q2NP276R
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50475652
PNG
(CHEMBL201258)
Show SMILES CC1=NC(C)=C(C(\C1=C(/O)OCCC(c1ccccc1)c1ccccc1)c1cccc(Cl)c1)C(O)=O |c:4,t:1|
Show InChI InChI=1S/C30H28ClNO4/c1-19-26(29(33)34)28(23-14-9-15-24(31)18-23)27(20(2)32-19)30(35)36-17-16-25(21-10-5-3-6-11-21)22-12-7-4-8-13-22/h3-15,18,25,28,35H,16-17H2,1-2H3,(H,33,34)/b30-27+
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n/an/a 360n/an/an/an/an/an/a



Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against L-type calcium channel in SD rat thoracic aorta by Magnus method


Bioorg Med Chem Lett 16: 798-802 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.021
BindingDB Entry DOI: 10.7270/Q2NP276R
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50383776
PNG
(CHEMBL2030594)
Show SMILES COC(OC)C1=C(C(C(C=N1)C(O)=O)c1ccc(Cl)c(Cl)c1)C(=O)OC\C=C\c1ccccc1 |c:9,t:5|
Show InChI InChI=1S/C25H23Cl2NO6/c1-32-25(33-2)22-21(24(31)34-12-6-9-15-7-4-3-5-8-15)20(17(14-28-22)23(29)30)16-10-11-18(26)19(27)13-16/h3-11,13-14,17,20,25H,12H2,1-2H3,(H,29,30)/b9-6+
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n/an/a 520n/an/an/an/an/an/a



Ajinomoto Pharmaceuticals Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of N-type voltage-dependent calcium channel CaV2.2 in human IMR32 cells assessed as inhibition of KCl-induced increase in intracellular ca...


Bioorg Med Chem Lett 22: 3639-42 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.051
BindingDB Entry DOI: 10.7270/Q2QV3NJX
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50479259
PNG
(CHEMBL451817)
Show SMILES COC(OC)C1=C(C(C(C(O)=O)=C(C)N1)c1cccc(Cl)c1)C(=O)OC\C=C\c1ccc(OC)cc1 |t:5,11|
Show InChI InChI=1S/C27H28ClNO7/c1-16-21(25(30)31)22(18-8-5-9-19(28)15-18)23(24(29-16)27(34-3)35-4)26(32)36-14-6-7-17-10-12-20(33-2)13-11-17/h5-13,15,22,27,29H,14H2,1-4H3,(H,30,31)/b7-6+
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n/an/a 540n/an/an/an/an/an/a



Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibition of voltage-dependent L-type calcium channel in rat thoracic aorta ring assessed as effect on high K+ induced contraction by Magnus method


Bioorg Med Chem Lett 18: 4813-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.096
BindingDB Entry DOI: 10.7270/Q208684R
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50383765
PNG
(CHEMBL2030603)
Show SMILES COc1c(Cl)cc(cc1Cl)C1C(C=NC=C1C(=O)OC\C=C\c1ccccc1)C(O)=O |c:13,15|
Show InChI InChI=1S/C23H19Cl2NO5/c1-30-21-18(24)10-15(11-19(21)25)20-16(22(27)28)12-26-13-17(20)23(29)31-9-5-8-14-6-3-2-4-7-14/h2-8,10-13,16,20H,9H2,1H3,(H,27,28)/b8-5+
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n/an/a 580n/an/an/an/an/an/a



Ajinomoto Pharmaceuticals Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of N-type voltage-dependent calcium channel CaV2.2 in human IMR32 cells assessed as inhibition of KCl-induced increase in intracellular ca...


Bioorg Med Chem Lett 22: 3639-42 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.051
BindingDB Entry DOI: 10.7270/Q2QV3NJX
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50383765
PNG
(CHEMBL2030603)
Show SMILES COc1c(Cl)cc(cc1Cl)C1C(C=NC=C1C(=O)OC\C=C\c1ccccc1)C(O)=O |c:13,15|
Show InChI InChI=1S/C23H19Cl2NO5/c1-30-21-18(24)10-15(11-19(21)25)20-16(22(27)28)12-26-13-17(20)23(29)31-9-5-8-14-6-3-2-4-7-14/h2-8,10-13,16,20H,9H2,1H3,(H,27,28)/b8-5+
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n/an/a 580n/an/an/an/an/an/a



Ajinomoto Pharmaceuticals Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of N-type voltage-dependent calcium channel CaV2.2 in human IMR32 cells assessed as inhibition of KCl-induced increase in intracellular ca...


Bioorg Med Chem Lett 22: 3639-42 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.051
BindingDB Entry DOI: 10.7270/Q2QV3NJX
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50475660
PNG
(CHEMBL201566)
Show SMILES C\C(CO\C(O)=C1\C(C(C(O)=O)=C(C)N=C1C)c1cccc(Cl)c1)=C/c1ccccc1 |c:14,t:11|
Show InChI InChI=1S/C25H24ClNO4/c1-15(12-18-8-5-4-6-9-18)14-31-25(30)22-17(3)27-16(2)21(24(28)29)23(22)19-10-7-11-20(26)13-19/h4-13,23,30H,14H2,1-3H3,(H,28,29)/b15-12+,25-22+
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n/an/a 680n/an/an/an/an/an/a



Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against N-type calcium channel by calcium influx into IMR32 cells


Bioorg Med Chem Lett 16: 798-802 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.021
BindingDB Entry DOI: 10.7270/Q2NP276R
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50479252
PNG
(CHEMBL511062)
Show SMILES COC(OC)C1=C(C(C(C(O)=O)=C(C)N1)c1cccc(Cl)c1)C(=O)OC\C=C\c1ccccc1Cl |t:5,11|
Show InChI InChI=1S/C26H25Cl2NO6/c1-15-20(24(30)31)21(17-9-6-11-18(27)14-17)22(23(29-15)26(33-2)34-3)25(32)35-13-7-10-16-8-4-5-12-19(16)28/h4-12,14,21,26,29H,13H2,1-3H3,(H,30,31)/b10-7+
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n/an/a 700n/an/an/an/an/an/a



Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibition of voltage-dependent L-type calcium channel in rat thoracic aorta ring assessed as effect on high K+ induced contraction by Magnus method


Bioorg Med Chem Lett 18: 4813-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.096
BindingDB Entry DOI: 10.7270/Q208684R
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50383769
PNG
(CHEMBL2030600)
Show SMILES OC(=O)C1C=NC=C(C1c1ccc(Cl)c(Cl)c1)C(=O)OC\C=C\c1ccccc1 |c:4,6|
Show InChI InChI=1S/C22H17Cl2NO4/c23-18-9-8-15(11-19(18)24)20-16(21(26)27)12-25-13-17(20)22(28)29-10-4-7-14-5-2-1-3-6-14/h1-9,11-13,16,20H,10H2,(H,26,27)/b7-4+
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n/an/a 750n/an/an/an/an/an/a



Ajinomoto Pharmaceuticals Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of N-type voltage-dependent calcium channel CaV2.2 in human IMR32 cells assessed as inhibition of KCl-induced increase in intracellular ca...


Bioorg Med Chem Lett 22: 3639-42 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.051
BindingDB Entry DOI: 10.7270/Q2QV3NJX
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50475664
PNG
(CHEMBL369934)
Show SMILES CC1=NC(C)=C(C(\C1=C(/O)OC\C=C\c1ccccc1)c1cccc(Br)c1)C(O)=O |c:4,t:1|
Show InChI InChI=1S/C24H22BrNO4/c1-15-20(23(27)28)22(18-11-6-12-19(25)14-18)21(16(2)26-15)24(29)30-13-7-10-17-8-4-3-5-9-17/h3-12,14,22,29H,13H2,1-2H3,(H,27,28)/b10-7+,24-21+
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n/an/a 790n/an/an/an/an/an/a



Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against N-type calcium channel by calcium influx into IMR32 cells


Bioorg Med Chem Lett 16: 798-802 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.021
BindingDB Entry DOI: 10.7270/Q2NP276R
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50475658
PNG
(CHEMBL201984)
Show SMILES CC1=NC(C)=C(C(\C1=C(/O)OC\C=C\C1CCCCC1)c1cccc(Cl)c1)C(O)=O |c:4,t:1|
Show InChI InChI=1S/C24H28ClNO4/c1-15-20(23(27)28)22(18-11-6-12-19(25)14-18)21(16(2)26-15)24(29)30-13-7-10-17-8-4-3-5-9-17/h6-7,10-12,14,17,22,29H,3-5,8-9,13H2,1-2H3,(H,27,28)/b10-7+,24-21+
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n/an/a 830n/an/an/an/an/an/a



Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against N-type calcium channel by calcium influx into IMR32 cells


Bioorg Med Chem Lett 16: 798-802 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.021
BindingDB Entry DOI: 10.7270/Q2NP276R
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50383765
PNG
(CHEMBL2030603)
Show SMILES COc1c(Cl)cc(cc1Cl)C1C(C=NC=C1C(=O)OC\C=C\c1ccccc1)C(O)=O |c:13,15|
Show InChI InChI=1S/C23H19Cl2NO5/c1-30-21-18(24)10-15(11-19(21)25)20-16(22(27)28)12-26-13-17(20)23(29)31-9-5-8-14-6-3-2-4-7-14/h2-8,10-13,16,20H,9H2,1H3,(H,27,28)/b8-5+
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n/an/a 840n/an/an/an/an/an/a



Ajinomoto Pharmaceuticals Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of N-type voltage-dependent calcium channel CaV2.2 in human IMR32 cells assessed as inhibition of KCl-induced increase in intracellular ca...


Bioorg Med Chem Lett 22: 3639-42 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.051
BindingDB Entry DOI: 10.7270/Q2QV3NJX
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50475651
PNG
(CHEMBL201599)
Show SMILES CC1=C(C(C(C(=O)NC\C=C\c2ccccc2)=C(C)N1)c1cccc(Cl)c1)C(O)=O |t:1,17|
Show InChI InChI=1S/C24H23ClN2O3/c1-15-20(23(28)26-13-7-10-17-8-4-3-5-9-17)22(18-11-6-12-19(25)14-18)21(24(29)30)16(2)27-15/h3-12,14,22,27H,13H2,1-2H3,(H,26,28)(H,29,30)/b10-7+
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n/an/a 850n/an/an/an/an/an/a



Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against L-type calcium channel in SD rat thoracic aorta by Magnus method


Bioorg Med Chem Lett 16: 798-802 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.021
BindingDB Entry DOI: 10.7270/Q2NP276R
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50475650
PNG
(CHEMBL203041)
Show SMILES CC1=NC(C)=C(C(\C1=C(/O)OC\C=C\c1ccc(C)cc1)c1cccc(Cl)c1)C(O)=O |c:4,t:1|
Show InChI InChI=1S/C25H24ClNO4/c1-15-9-11-18(12-10-15)6-5-13-31-25(30)22-17(3)27-16(2)21(24(28)29)23(22)19-7-4-8-20(26)14-19/h4-12,14,23,30H,13H2,1-3H3,(H,28,29)/b6-5+,25-22+
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n/an/a 890n/an/an/an/an/an/a



Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against N-type calcium channel by calcium influx into IMR32 cells


Bioorg Med Chem Lett 16: 798-802 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.021
BindingDB Entry DOI: 10.7270/Q2NP276R
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50475662
PNG
(CHEMBL201860)
Show SMILES CC1=NC(C)=C(C(\C1=C(/O)OCc1ccc2ccccc2c1)c1cccc(Cl)c1)C(O)=O |c:4,t:1|
Show InChI InChI=1S/C26H22ClNO4/c1-15-22(25(29)30)24(20-8-5-9-21(27)13-20)23(16(2)28-15)26(31)32-14-17-10-11-18-6-3-4-7-19(18)12-17/h3-13,24,31H,14H2,1-2H3,(H,29,30)/b26-23+
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n/an/a 1.00E+3n/an/an/an/an/an/a



Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against N-type calcium channel by calcium influx into IMR32 cells


Bioorg Med Chem Lett 16: 798-802 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.021
BindingDB Entry DOI: 10.7270/Q2NP276R
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50383775
PNG
(CHEMBL2030593)
Show SMILES COC(OC)C1=C(C(C(C=N1)C(O)=O)c1cc(Cl)cc(Cl)c1)C(=O)OC\C=C\c1ccccc1 |c:9,t:5|
Show InChI InChI=1S/C25H23Cl2NO6/c1-32-25(33-2)22-21(24(31)34-10-6-9-15-7-4-3-5-8-15)20(19(14-28-22)23(29)30)16-11-17(26)13-18(27)12-16/h3-9,11-14,19-20,25H,10H2,1-2H3,(H,29,30)/b9-6+
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n/an/a 1.00E+3n/an/an/an/an/an/a



Ajinomoto Pharmaceuticals Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of N-type voltage-dependent calcium channel CaV2.2 in human IMR32 cells assessed as inhibition of KCl-induced increase in intracellular ca...


Bioorg Med Chem Lett 22: 3639-42 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.051
BindingDB Entry DOI: 10.7270/Q2QV3NJX
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50475669
PNG
(CHEMBL382072)
Show SMILES CC1=NC(C)=C(C(\C1=C(/O)OC\C=C\c1ccccc1)c1cccc(Cl)c1)C(O)=O |c:4,t:1|
Show InChI InChI=1S/C24H22ClNO4/c1-15-20(23(27)28)22(18-11-6-12-19(25)14-18)21(16(2)26-15)24(29)30-13-7-10-17-8-4-3-5-9-17/h3-12,14,22,29H,13H2,1-2H3,(H,27,28)/b10-7+,24-21+
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n/an/a 1.00E+3n/an/an/an/an/an/a



Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against N-type calcium channel by calcium influx into IMR32 cells


Bioorg Med Chem Lett 16: 798-802 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.021
BindingDB Entry DOI: 10.7270/Q2NP276R
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1S


(Rattus norvegicus)
BDBM50479258
PNG
(CHEMBL453088)
Show SMILES COC(OC)C1=C(C(C(C(O)=O)=C(C)N1)c1cccc(Cl)c1)C(=O)OC\C=C\c1cccc(Cl)c1 |t:5,11|
Show InChI InChI=1S/C26H25Cl2NO6/c1-15-20(24(30)31)21(17-9-5-11-19(28)14-17)22(23(29-15)26(33-2)34-3)25(32)35-12-6-8-16-7-4-10-18(27)13-16/h4-11,13-14,21,26,29H,12H2,1-3H3,(H,30,31)/b8-6+
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n/an/a 1.00E+3n/an/an/an/an/an/a



Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibition of voltage-dependent L-type calcium channel in rat thoracic aorta ring assessed as effect on high K+ induced contraction by Magnus method


Bioorg Med Chem Lett 18: 4813-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.096
BindingDB Entry DOI: 10.7270/Q208684R
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50383774
PNG
(CHEMBL2030592)
Show SMILES COC(OC)C1=C(C(C(C=N1)C(O)=O)c1ccc(Cl)cc1)C(=O)OC\C=C\c1ccccc1 |c:9,t:5|
Show InChI InChI=1S/C25H24ClNO6/c1-31-25(32-2)22-21(24(30)33-14-6-9-16-7-4-3-5-8-16)20(19(15-27-22)23(28)29)17-10-12-18(26)13-11-17/h3-13,15,19-20,25H,14H2,1-2H3,(H,28,29)/b9-6+
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n/an/a 1.10E+3n/an/an/an/an/an/a



Ajinomoto Pharmaceuticals Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of N-type voltage-dependent calcium channel CaV2.2 in human IMR32 cells assessed as inhibition of KCl-induced increase in intracellular ca...


Bioorg Med Chem Lett 22: 3639-42 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.051
BindingDB Entry DOI: 10.7270/Q2QV3NJX
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50475652
PNG
(CHEMBL201258)
Show SMILES CC1=NC(C)=C(C(\C1=C(/O)OCCC(c1ccccc1)c1ccccc1)c1cccc(Cl)c1)C(O)=O |c:4,t:1|
Show InChI InChI=1S/C30H28ClNO4/c1-19-26(29(33)34)28(23-14-9-15-24(31)18-23)27(20(2)32-19)30(35)36-17-16-25(21-10-5-3-6-11-21)22-12-7-4-8-13-22/h3-15,18,25,28,35H,16-17H2,1-2H3,(H,33,34)/b30-27+
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n/an/a 1.10E+3n/an/an/an/an/an/a



Ajinomoto company Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against N-type calcium channel by calcium influx into IMR32 cells


Bioorg Med Chem Lett 16: 798-802 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.021
BindingDB Entry DOI: 10.7270/Q2NP276R
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50383773
PNG
(CHEMBL2030591)
Show SMILES COC(OC)C1=C(C(C(C=N1)C(O)=O)c1cccc(Cl)c1)C(=O)OC\C=C\c1ccccc1 |c:9,t:5|
Show InChI InChI=1S/C25H24ClNO6/c1-31-25(32-2)22-21(24(30)33-13-7-10-16-8-4-3-5-9-16)20(19(15-27-22)23(28)29)17-11-6-12-18(26)14-17/h3-12,14-15,19-20,25H,13H2,1-2H3,(H,28,29)/b10-7+
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n/an/a 1.10E+3n/an/an/an/an/an/a



Ajinomoto Pharmaceuticals Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of N-type voltage-dependent calcium channel CaV2.2 in human IMR32 cells assessed as inhibition of KCl-induced increase in intracellular ca...


Bioorg Med Chem Lett 22: 3639-42 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.051
BindingDB Entry DOI: 10.7270/Q2QV3NJX
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50383766
PNG
(CHEMBL2030597)
Show SMILES COC(OC)C1=C(C(C(C=N1)C(O)=O)c1cccc(c1)C(F)(F)F)C(=O)OC\C=C\c1ccccc1 |c:9,t:5|
Show InChI InChI=1S/C26H24F3NO6/c1-34-25(35-2)22-21(24(33)36-13-7-10-16-8-4-3-5-9-16)20(19(15-30-22)23(31)32)17-11-6-12-18(14-17)26(27,28)29/h3-12,14-15,19-20,25H,13H2,1-2H3,(H,31,32)/b10-7+
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n/an/a 1.10E+3n/an/an/an/an/an/a



Ajinomoto Pharmaceuticals Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of N-type voltage-dependent calcium channel CaV2.2 in human IMR32 cells assessed as inhibition of KCl-induced increase in intracellular ca...


Bioorg Med Chem Lett 22: 3639-42 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.051
BindingDB Entry DOI: 10.7270/Q2QV3NJX
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50383778
PNG
(CHEMBL2030596)
Show SMILES COC(OC)C1=C(C(C(C=N1)C(O)=O)c1cc(Cl)c(OC)c(Cl)c1)C(=O)OC\C=C\c1ccccc1 |c:9,t:5|
Show InChI InChI=1S/C26H25Cl2NO7/c1-33-23-18(27)12-16(13-19(23)28)20-17(24(30)31)14-29-22(26(34-2)35-3)21(20)25(32)36-11-7-10-15-8-5-4-6-9-15/h4-10,12-14,17,20,26H,11H2,1-3H3,(H,30,31)/b10-7+
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n/an/a 1.20E+3n/an/an/an/an/an/a



Ajinomoto Pharmaceuticals Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of N-type voltage-dependent calcium channel CaV2.2 in human IMR32 cells assessed as inhibition of KCl-induced increase in intracellular ca...


Bioorg Med Chem Lett 22: 3639-42 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.051
BindingDB Entry DOI: 10.7270/Q2QV3NJX
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50383768
PNG
(CHEMBL2030599)
Show SMILES OC(=O)C1C=NC=C(C1c1ccc(Cl)cc1)C(=O)OC\C=C\c1ccccc1 |c:4,6|
Show InChI InChI=1S/C22H18ClNO4/c23-17-10-8-16(9-11-17)20-18(21(25)26)13-24-14-19(20)22(27)28-12-4-7-15-5-2-1-3-6-15/h1-11,13-14,18,20H,12H2,(H,25,26)/b7-4+
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n/an/a 1.20E+3n/an/an/an/an/an/a



Ajinomoto Pharmaceuticals Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of N-type voltage-dependent calcium channel CaV2.2 in human IMR32 cells assessed as inhibition of KCl-induced increase in intracellular ca...


Bioorg Med Chem Lett 22: 3639-42 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.051
BindingDB Entry DOI: 10.7270/Q2QV3NJX
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50383770
PNG
(CHEMBL2030601)
Show SMILES OC(=O)C1C=NC=C(C1c1cccc(c1)C(F)(F)F)C(=O)OC\C=C\c1ccccc1 |c:4,6|
Show InChI InChI=1S/C23H18F3NO4/c24-23(25,26)17-10-4-9-16(12-17)20-18(21(28)29)13-27-14-19(20)22(30)31-11-5-8-15-6-2-1-3-7-15/h1-10,12-14,18,20H,11H2,(H,28,29)/b8-5+
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n/an/a 1.20E+3n/an/an/an/an/an/a



Ajinomoto Pharmaceuticals Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of N-type voltage-dependent calcium channel CaV2.2 in human IMR32 cells assessed as inhibition of KCl-induced increase in intracellular ca...


Bioorg Med Chem Lett 22: 3639-42 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.051
BindingDB Entry DOI: 10.7270/Q2QV3NJX
More data for this
Ligand-Target Pair
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