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Compile Data Set for Download or QSAR

Found 10 hits with Last Name = 'joslyn' and Initial = 'af'   
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-1C/alpha-1D/alpha-1F/alpha-1S


(Homo sapiens (Human))
BDBM50227481
PNG
(CHEMBL286157)
Show SMILES CCCCCCCCO\C(O)=C1\C(C(C(=O)OCC)=C(C)N=C1C)c1cccc(c1)[N+]([O-])=O |c:21,t:18|
Show InChI InChI=1S/C25H34N2O6/c1-5-7-8-9-10-11-15-33-25(29)22-18(4)26-17(3)21(24(28)32-6-2)23(22)19-13-12-14-20(16-19)27(30)31/h12-14,16,23,29H,5-11,15H2,1-4H3/b25-22+
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n/an/a 0.0100n/an/an/an/an/an/a



State University of New York

Curated by ChEMBL


Assay Description
Inhibition of [3H]nitrendipine binding to L-type calcium channel of guinea pig ileal longitudinal smooth muscle


J Med Chem 31: 1489-92 (1988)


BindingDB Entry DOI: 10.7270/Q28W3GJ5
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1C/alpha-1D/alpha-1F/alpha-1S


(Homo sapiens (Human))
BDBM50227474
PNG
(CHEMBL286598)
Show SMILES CCO\C(O)=C1\C(C(C(=O)OCCO\C(O)=C2\C(C(C(=O)OC(C)C)=C(C)N=C2C)c2cccc(c2)[N+]([O-])=O)=C(C)N=C1C)c1ccc(cc1)[N+]([O-])=O |c:27,43,t:24,40|
Show InChI InChI=1S/C37H40N4O12/c1-8-50-34(42)28-20(4)38-21(5)29(32(28)24-12-14-26(15-13-24)40(46)47)35(43)51-16-17-52-36(44)30-22(6)39-23(7)31(37(45)53-19(2)3)33(30)25-10-9-11-27(18-25)41(48)49/h9-15,18-19,32-33,42,44H,8,16-17H2,1-7H3/b34-28+,36-30+
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n/an/a 0.0170n/an/an/an/an/an/a



State University of New York

Curated by ChEMBL


Assay Description
Inhibition of [3H]nitrendipine binding to L-type calcium channel of guinea pig ileal longitudinal smooth muscle


J Med Chem 31: 1489-92 (1988)


BindingDB Entry DOI: 10.7270/Q28W3GJ5
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1C/alpha-1D/alpha-1F/alpha-1S


(Homo sapiens (Human))
BDBM50227478
PNG
(CHEMBL37402)
Show SMILES CCO\C(O)=C1\C(C(C(=O)OCCCCO\C(O)=C2\C(C(C(=O)OCC)=C(C)N=C2C)c2cccc(c2)[N+]([O-])=O)=C(C)N=C1C)c1cccc(c1)[N+]([O-])=O |c:28,44,t:25,41|
Show InChI InChI=1S/C38H42N4O12/c1-7-51-35(43)29-21(3)39-23(5)31(33(29)25-13-11-15-27(19-25)41(47)48)37(45)53-17-9-10-18-54-38(46)32-24(6)40-22(4)30(36(44)52-8-2)34(32)26-14-12-16-28(20-26)42(49)50/h11-16,19-20,33-34,43,46H,7-10,17-18H2,1-6H3/b35-29+,38-32+
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n/an/a 0.0220n/an/an/an/an/an/a



State University of New York

Curated by ChEMBL


Assay Description
Inhibition of [3H]nitrendipine binding to L-type calcium channel of guinea pig ileal longitudinal smooth muscle


J Med Chem 31: 1489-92 (1988)


BindingDB Entry DOI: 10.7270/Q28W3GJ5
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1C/alpha-1D/alpha-1F/alpha-1S


(Homo sapiens (Human))
BDBM50227480
PNG
(CHEMBL37899)
Show SMILES CCO\C(O)=C1\C(C(C(=O)OCCCCCCCCO\C(O)=C2\C(C(C(=O)OCC)=C(C)N=C2C)c2cccc(c2)[N+]([O-])=O)=C(C)N=C1C)c1cccc(c1)[N+]([O-])=O |c:32,48,t:29,45|
Show InChI InChI=1S/C42H50N4O12/c1-7-55-39(47)33-25(3)43-27(5)35(37(33)29-17-15-19-31(23-29)45(51)52)41(49)57-21-13-11-9-10-12-14-22-58-42(50)36-28(6)44-26(4)34(40(48)56-8-2)38(36)30-18-16-20-32(24-30)46(53)54/h15-20,23-24,37-38,47,50H,7-14,21-22H2,1-6H3/b39-33+,42-36+
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n/an/a 0.0300n/an/an/an/an/an/a



State University of New York

Curated by ChEMBL


Assay Description
Inhibition of [3H]nitrendipine binding to L-type calcium channel of guinea pig ileal longitudinal smooth muscle


J Med Chem 31: 1489-92 (1988)


BindingDB Entry DOI: 10.7270/Q28W3GJ5
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1C/alpha-1D/alpha-1F/alpha-1S


(Homo sapiens (Human))
BDBM50227476
PNG
(CHEMBL204616)
Show SMILES CCO\C(O)=C1\C(C(C(=O)OCCCCCCCCCCO\C(O)=C2\C(C(C(=O)OCC)=C(C)N=C2C)c2cccc(c2)[N+]([O-])=O)=C(C)N=C1C)c1cccc(c1)[N+]([O-])=O |c:34,50,t:31,47|
Show InChI InChI=1S/C44H54N4O12/c1-7-57-41(49)35-27(3)45-29(5)37(39(35)31-19-17-21-33(25-31)47(53)54)43(51)59-23-15-13-11-9-10-12-14-16-24-60-44(52)38-30(6)46-28(4)36(42(50)58-8-2)40(38)32-20-18-22-34(26-32)48(55)56/h17-22,25-26,39-40,49,52H,7-16,23-24H2,1-6H3/b41-35+,44-38+
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n/an/a 0.0330n/an/an/an/an/an/a



State University of New York

Curated by ChEMBL


Assay Description
Inhibition of [3H]nitrendipine binding to L-type calcium channel of guinea pig ileal longitudinal smooth muscle


J Med Chem 31: 1489-92 (1988)


BindingDB Entry DOI: 10.7270/Q28W3GJ5
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1C/alpha-1D/alpha-1F/alpha-1S


(Homo sapiens (Human))
BDBM50227479
PNG
(CHEMBL35368)
Show SMILES CCO\C(O)=C1\C(C(C(=O)OCCCCCCO\C(O)=C2\C(C(C(=O)OCC)=C(C)N=C2C)c2cccc(c2)[N+]([O-])=O)=C(C)N=C1C)c1cccc(c1)[N+]([O-])=O |c:30,46,t:27,43|
Show InChI InChI=1S/C40H46N4O12/c1-7-53-37(45)31-23(3)41-25(5)33(35(31)27-15-13-17-29(21-27)43(49)50)39(47)55-19-11-9-10-12-20-56-40(48)34-26(6)42-24(4)32(38(46)54-8-2)36(34)28-16-14-18-30(22-28)44(51)52/h13-18,21-22,35-36,45,48H,7-12,19-20H2,1-6H3/b37-31+,40-34+
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n/an/a 0.0450n/an/an/an/an/an/a



State University of New York

Curated by ChEMBL


Assay Description
Inhibition of [3H]nitrendipine binding to L-type calcium channel of guinea pig ileal longitudinal smooth muscle


J Med Chem 31: 1489-92 (1988)


BindingDB Entry DOI: 10.7270/Q28W3GJ5
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1C/alpha-1D/alpha-1F/alpha-1S


(Homo sapiens (Human))
BDBM50227473
PNG
(CHEMBL1099207)
Show SMILES CCOC(=O)C1=C(C)NC(C)=C(C1c1cccc(c1)[N+]([O-])=O)C(=O)OCC |c:5,10|
Show InChI InChI=1S/C19H22N2O6/c1-5-26-18(22)15-11(3)20-12(4)16(19(23)27-6-2)17(15)13-8-7-9-14(10-13)21(24)25/h7-10,17,20H,5-6H2,1-4H3
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n/an/a 0.0460n/an/an/an/an/an/a



State University of New York

Curated by ChEMBL


Assay Description
Inhibition of [3H]nitrendipine binding to L-type calcium channel of guinea pig ileal longitudinal smooth muscle


J Med Chem 31: 1489-92 (1988)


BindingDB Entry DOI: 10.7270/Q28W3GJ5
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1C/alpha-1D/alpha-1F/alpha-1S


(Homo sapiens (Human))
BDBM50227475
PNG
(CHEMBL285868)
Show SMILES CCO\C(O)=C1\C(C(C(=O)OCCCCCCCCCCCCO\C(O)=C2\C(C(C(=O)OCC)=C(C)N=C2C)c2cccc(c2)[N+]([O-])=O)=C(C)N=C1C)c1cccc(c1)[N+]([O-])=O |c:36,52,t:33,49|
Show InChI InChI=1S/C46H58N4O12/c1-7-59-43(51)37-29(3)47-31(5)39(41(37)33-21-19-23-35(27-33)49(55)56)45(53)61-25-17-15-13-11-9-10-12-14-16-18-26-62-46(54)40-32(6)48-30(4)38(44(52)60-8-2)42(40)34-22-20-24-36(28-34)50(57)58/h19-24,27-28,41-42,51,54H,7-18,25-26H2,1-6H3/b43-37+,46-40+
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n/an/a 0.0500n/an/an/an/an/an/a



State University of New York

Curated by ChEMBL


Assay Description
Inhibition of [3H]nitrendipine binding to L-type calcium channel of guinea pig ileal longitudinal smooth muscle


J Med Chem 31: 1489-92 (1988)


BindingDB Entry DOI: 10.7270/Q28W3GJ5
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1C/alpha-1D/alpha-1F/alpha-1S


(Homo sapiens (Human))
BDBM50318494
PNG
(3-ethyl 5-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,...)
Show SMILES CCOC(=O)C1=C(C)N=C(C)C(C1c1cccc(c1)[N+]([O-])=O)C(=O)OC |c:5,t:8|
Show InChI InChI=1S/C18H20N2O6/c1-5-26-18(22)15-11(3)19-10(2)14(17(21)25-4)16(15)12-7-6-8-13(9-12)20(23)24/h6-9,14,16H,5H2,1-4H3
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n/an/a 0.150n/an/an/an/an/an/a



State University of New York

Curated by ChEMBL


Assay Description
Inhibition of [3H]nitrendipine binding to L-type calcium channel of guinea pig ileal longitudinal smooth muscle


J Med Chem 31: 1489-92 (1988)


BindingDB Entry DOI: 10.7270/Q28W3GJ5
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1C/alpha-1D/alpha-1F/alpha-1S


(Homo sapiens (Human))
BDBM50227477
PNG
(CHEMBL35123)
Show SMILES CCO\C(O)=C1\C(C(C(=O)OCCO\C(O)=C2\C(C(C(=O)OCC)=C(C)N=C2C)c2cccc(c2)[N+]([O-])=O)=C(C)N=C1C)c1cccc(c1)[N+]([O-])=O |c:26,42,t:23,39|
Show InChI InChI=1S/C36H38N4O12/c1-7-49-33(41)27-19(3)37-21(5)29(31(27)23-11-9-13-25(17-23)39(45)46)35(43)51-15-16-52-36(44)30-22(6)38-20(4)28(34(42)50-8-2)32(30)24-12-10-14-26(18-24)40(47)48/h9-14,17-18,31-32,41,44H,7-8,15-16H2,1-6H3/b33-27+,36-30+
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n/an/a 0.390n/an/an/an/an/an/a



State University of New York

Curated by ChEMBL


Assay Description
Inhibition of [3H]nitrendipine binding to L-type calcium channel of guinea pig ileal longitudinal smooth muscle


J Med Chem 31: 1489-92 (1988)


BindingDB Entry DOI: 10.7270/Q28W3GJ5
More data for this
Ligand-Target Pair