Found 106 hits of Enz. Inhib. data with enzyme = 'Calcium channel' and Substrate = 'to-be-curated' Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
Calcium channel
(RAT) | BDBM50336640
 ((nifedipine) 2,6-Dimethyl-4-(2-nitro-phenyl)-1,4-d...)Show SMILES COC(=O)C1C(C(C(=O)OC)=C(C)N=C1C)c1ccccc1[N+]([O-])=O Show InChI InChI=1S/C17H18N2O6/c1-9-13(16(20)24-3)15(14(10(2)18-9)17(21)25-4)11-7-5-6-8-12(11)19(22)23/h5-8,13,15H,1-4H3 | UniProtKB/SwissProt
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| 0.130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by PDSP Ki Database
| |
Life Sci 30: 2191-202 (1982)
BindingDB Entry DOI: 10.7270/Q25719JV |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM50318494
 (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 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 | UniProtKB/SwissProt
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| 0.210 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by PDSP Ki Database
| |
Life Sci 30: 2191-202 (1982)
BindingDB Entry DOI: 10.7270/Q25719JV |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM50336640
 ((nifedipine) 2,6-Dimethyl-4-(2-nitro-phenyl)-1,4-d...)Show SMILES COC(=O)C1C(C(C(=O)OC)=C(C)N=C1C)c1ccccc1[N+]([O-])=O Show InChI InChI=1S/C17H18N2O6/c1-9-13(16(20)24-3)15(14(10(2)18-9)17(21)25-4)11-7-5-6-8-12(11)19(22)23/h5-8,13,15H,1-4H3 | UniProtKB/SwissProt
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| 0.230 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Janssen Research Foundation
Curated by PDSP Ki Database
| |
Psychopharmacology (Berl) 124: 57-73 (1996)
BindingDB Entry DOI: 10.7270/Q2610XV6 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM82056
 (CAS_4499 | NSC_4499 | Nisoldipine)Show SMILES COC(=O)C1C(C(C(=O)OCC(C)C)=C(C)N=C1C)c1ccccc1[N+]([O-])=O Show InChI InChI=1S/C20H24N2O6/c1-11(2)10-28-20(24)17-13(4)21-12(3)16(19(23)27-5)18(17)14-8-6-7-9-15(14)22(25)26/h6-9,11,16,18H,10H2,1-5H3 | UniProtKB/SwissProt
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| 0.330 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by PDSP Ki Database
| |
Life Sci 30: 2191-202 (1982)
BindingDB Entry DOI: 10.7270/Q25719JV |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM50318494
 (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 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 | UniProtKB/SwissProt
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| 0.350 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by PDSP Ki Database
| |
Life Sci 30: 2191-202 (1982)
BindingDB Entry DOI: 10.7270/Q25719JV |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM82056
 (CAS_4499 | NSC_4499 | Nisoldipine)Show SMILES COC(=O)C1C(C(C(=O)OCC(C)C)=C(C)N=C1C)c1ccccc1[N+]([O-])=O Show InChI InChI=1S/C20H24N2O6/c1-11(2)10-28-20(24)17-13(4)21-12(3)16(19(23)27-5)18(17)14-8-6-7-9-15(14)22(25)26/h6-9,11,16,18H,10H2,1-5H3 | UniProtKB/SwissProt
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| 0.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by PDSP Ki Database
| |
Life Sci 30: 2191-202 (1982)
BindingDB Entry DOI: 10.7270/Q25719JV |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM50318493
 (3-isopropyl 5-(2-methoxyethyl) 2,6-dimethyl-4-(3-n...)Show SMILES COCCOC(=O)C1=C(C)N=C(C)C(C1c1cccc(c1)[N+]([O-])=O)C(=O)OC(C)C Show InChI InChI=1S/C21H26N2O7/c1-12(2)30-21(25)18-14(4)22-13(3)17(20(24)29-10-9-28-5)19(18)15-7-6-8-16(11-15)23(26)27/h6-8,11-12,18-19H,9-10H2,1-5H3 | UniProtKB/SwissProt
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| 0.560 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by PDSP Ki Database
| |
Life Sci 30: 2191-202 (1982)
BindingDB Entry DOI: 10.7270/Q25719JV |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM50336640
 ((nifedipine) 2,6-Dimethyl-4-(2-nitro-phenyl)-1,4-d...)Show SMILES COC(=O)C1C(C(C(=O)OC)=C(C)N=C1C)c1ccccc1[N+]([O-])=O Show InChI InChI=1S/C17H18N2O6/c1-9-13(16(20)24-3)15(14(10(2)18-9)17(21)25-4)11-7-5-6-8-12(11)19(22)23/h5-8,13,15H,1-4H3 | UniProtKB/SwissProt
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| 0.600 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by PDSP Ki Database
| |
Life Sci 30: 2191-202 (1982)
BindingDB Entry DOI: 10.7270/Q25719JV |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM50318493
 (3-isopropyl 5-(2-methoxyethyl) 2,6-dimethyl-4-(3-n...)Show SMILES COCCOC(=O)C1=C(C)N=C(C)C(C1c1cccc(c1)[N+]([O-])=O)C(=O)OC(C)C Show InChI InChI=1S/C21H26N2O7/c1-12(2)30-21(25)18-14(4)22-13(3)17(20(24)29-10-9-28-5)19(18)15-7-6-8-16(11-15)23(26)27/h6-8,11-12,18-19H,9-10H2,1-5H3 | UniProtKB/SwissProt
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| 0.790 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by PDSP Ki Database
| |
Life Sci 30: 2191-202 (1982)
BindingDB Entry DOI: 10.7270/Q25719JV |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM50318494
 (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 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 | UniProtKB/SwissProt
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| 1.76 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM50336640
 ((nifedipine) 2,6-Dimethyl-4-(2-nitro-phenyl)-1,4-d...)Show SMILES COC(=O)C1C(C(C(=O)OC)=C(C)N=C1C)c1ccccc1[N+]([O-])=O Show InChI InChI=1S/C17H18N2O6/c1-9-13(16(20)24-3)15(14(10(2)18-9)17(21)25-4)11-7-5-6-8-12(11)19(22)23/h5-8,13,15H,1-4H3 | UniProtKB/SwissProt
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| 2.06 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM50318493
 (3-isopropyl 5-(2-methoxyethyl) 2,6-dimethyl-4-(3-n...)Show SMILES COCCOC(=O)C1=C(C)N=C(C)C(C1c1cccc(c1)[N+]([O-])=O)C(=O)OC(C)C Show InChI InChI=1S/C21H26N2O7/c1-12(2)30-21(25)18-14(4)22-13(3)17(20(24)29-10-9-28-5)19(18)15-7-6-8-16(11-15)23(26)27/h6-8,11-12,18-19H,9-10H2,1-5H3 | UniProtKB/SwissProt
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| 2.28 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM82057
 (CAS_107928 | CAS_65832 | D888,(+) | D888,(-) | NSC...)Show SMILES COc1cccc(CCN(C)CCCC(C#N)(C(C)C)c2ccc(OC)c(OC)c2)c1 Show InChI InChI=1S/C26H36N2O3/c1-20(2)26(19-27,22-11-12-24(30-5)25(18-22)31-6)14-8-15-28(3)16-13-21-9-7-10-23(17-21)29-4/h7,9-12,17-18,20H,8,13-16H2,1-6H3 | UniProtKB/SwissProt
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| 2.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM82056
 (CAS_4499 | NSC_4499 | Nisoldipine)Show SMILES COC(=O)C1C(C(C(=O)OCC(C)C)=C(C)N=C1C)c1ccccc1[N+]([O-])=O Show InChI InChI=1S/C20H24N2O6/c1-11(2)10-28-20(24)17-13(4)21-12(3)16(19(23)27-5)18(17)14-8-6-7-9-15(14)22(25)26/h6-9,11,16,18H,10H2,1-5H3 | UniProtKB/SwissProt
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| 2.79 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM26948
 (8-[4,4-bis(4-fluorophenyl)butyl]-1-phenyl-1,3,8-tr...)Show SMILES Fc1ccc(cc1)C(CCCN1CCC2(CC1)N(CNC2=O)c1ccccc1)c1ccc(F)cc1 Show InChI InChI=1S/C29H31F2N3O/c30-24-12-8-22(9-13-24)27(23-10-14-25(31)15-11-23)7-4-18-33-19-16-29(17-20-33)28(35)32-21-34(29)26-5-2-1-3-6-26/h1-3,5-6,8-15,27H,4,7,16-21H2,(H,32,35) | UniProtKB/SwissProt
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| 7.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Janssen Research Foundation
Curated by PDSP Ki Database
| |
Psychopharmacology (Berl) 124: 57-73 (1996)
BindingDB Entry DOI: 10.7270/Q2610XV6 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM82057
 (CAS_107928 | CAS_65832 | D888,(+) | D888,(-) | NSC...)Show SMILES COc1cccc(CCN(C)CCCC(C#N)(C(C)C)c2ccc(OC)c(OC)c2)c1 Show InChI InChI=1S/C26H36N2O3/c1-20(2)26(19-27,22-11-12-24(30-5)25(18-22)31-6)14-8-15-28(3)16-13-21-9-7-10-23(17-21)29-4/h7,9-12,17-18,20H,8,13-16H2,1-6H3 | UniProtKB/SwissProt
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| 9.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM81939
 (CAS_52-53-9 | NSC_62969 | VERAPAMIL)Show SMILES COc1ccc(CCN(C)CCCC(C#N)(C(C)C)c2ccc(OC)c(OC)c2)cc1OC Show InChI InChI=1S/C27H38N2O4/c1-20(2)27(19-28,22-10-12-24(31-5)26(18-22)33-7)14-8-15-29(3)16-13-21-9-11-23(30-4)25(17-21)32-6/h9-12,17-18,20H,8,13-16H2,1-7H3 | UniProtKB/SwissProt
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| 10.6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by PDSP Ki Database
| |
Life Sci 30: 2191-202 (1982)
BindingDB Entry DOI: 10.7270/Q25719JV |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM82061
 (CAS_119442 | D600 | GALLOPAMIL | NSC_119442)Show SMILES COc1ccc(CCN(C)CCCC(C#N)(C(C)C)c2cc(OC)c(OC)c(OC)c2)cc1OC Show InChI InChI=1S/C28H40N2O5/c1-20(2)28(19-29,22-17-25(33-6)27(35-8)26(18-22)34-7)13-9-14-30(3)15-12-21-10-11-23(31-4)24(16-21)32-5/h10-11,16-18,20H,9,12-15H2,1-8H3 | UniProtKB/SwissProt
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| 21.4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM82061
 (CAS_119442 | D600 | GALLOPAMIL | NSC_119442)Show SMILES COc1ccc(CCN(C)CCCC(C#N)(C(C)C)c2cc(OC)c(OC)c(OC)c2)cc1OC Show InChI InChI=1S/C28H40N2O5/c1-20(2)28(19-29,22-17-25(33-6)27(35-8)26(18-22)34-7)13-9-14-30(3)15-12-21-10-11-23(31-4)24(16-21)32-5/h10-11,16-18,20H,9,12-15H2,1-8H3 | UniProtKB/SwissProt
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| 22.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM81939
 (CAS_52-53-9 | NSC_62969 | VERAPAMIL)Show SMILES COc1ccc(CCN(C)CCCC(C#N)(C(C)C)c2ccc(OC)c(OC)c2)cc1OC Show InChI InChI=1S/C27H38N2O4/c1-20(2)27(19-28,22-10-12-24(31-5)26(18-22)33-7)14-8-15-29(3)16-13-21-9-11-23(30-4)25(17-21)32-6/h9-12,17-18,20H,8,13-16H2,1-7H3 | UniProtKB/SwissProt
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| 38 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by PDSP Ki Database
| |
Life Sci 30: 2191-202 (1982)
BindingDB Entry DOI: 10.7270/Q25719JV |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM81939
 (CAS_52-53-9 | NSC_62969 | VERAPAMIL)Show SMILES COc1ccc(CCN(C)CCCC(C#N)(C(C)C)c2ccc(OC)c(OC)c2)cc1OC Show InChI InChI=1S/C27H38N2O4/c1-20(2)27(19-28,22-10-12-24(31-5)26(18-22)33-7)14-8-15-29(3)16-13-21-9-11-23(30-4)25(17-21)32-6/h9-12,17-18,20H,8,13-16H2,1-7H3 | UniProtKB/SwissProt
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| 40.3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM82061
 (CAS_119442 | D600 | GALLOPAMIL | NSC_119442)Show SMILES COc1ccc(CCN(C)CCCC(C#N)(C(C)C)c2cc(OC)c(OC)c(OC)c2)cc1OC Show InChI InChI=1S/C28H40N2O5/c1-20(2)28(19-29,22-17-25(33-6)27(35-8)26(18-22)34-7)13-9-14-30(3)15-12-21-10-11-23(31-4)24(16-21)32-5/h10-11,16-18,20H,9,12-15H2,1-8H3 | UniProtKB/SwissProt
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| 42 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona
Curated by PDSP Ki Database
| |
Life Sci 30: 2191-202 (1982)
BindingDB Entry DOI: 10.7270/Q25719JV |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM82057
 (CAS_107928 | CAS_65832 | D888,(+) | D888,(-) | NSC...)Show SMILES COc1cccc(CCN(C)CCCC(C#N)(C(C)C)c2ccc(OC)c(OC)c2)c1 Show InChI InChI=1S/C26H36N2O3/c1-20(2)26(19-27,22-11-12-24(30-5)25(18-22)31-6)14-8-15-28(3)16-13-21-9-7-10-23(17-21)29-4/h7,9-12,17-18,20H,8,13-16H2,1-6H3 | UniProtKB/SwissProt
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| 45.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM82057
 (CAS_107928 | CAS_65832 | D888,(+) | D888,(-) | NSC...)Show SMILES COc1cccc(CCN(C)CCCC(C#N)(C(C)C)c2ccc(OC)c(OC)c2)c1 Show InChI InChI=1S/C26H36N2O3/c1-20(2)26(19-27,22-11-12-24(30-5)25(18-22)31-6)14-8-15-28(3)16-13-21-9-7-10-23(17-21)29-4/h7,9-12,17-18,20H,8,13-16H2,1-6H3 | UniProtKB/SwissProt
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| 54.2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM50334150
 (1-(1-(4,4-bis(4-fluorophenyl)butyl)piperidin-4-yl)...)Show SMILES Fc1ccc(cc1)C(CCCN1CCC(CC1)n1c2ccccc2[nH]c1=O)c1ccc(F)cc1 Show InChI InChI=1S/C28H29F2N3O/c29-22-11-7-20(8-12-22)25(21-9-13-23(30)14-10-21)4-3-17-32-18-15-24(16-19-32)33-27-6-2-1-5-26(27)31-28(33)34/h1-2,5-14,24-25H,3-4,15-19H2,(H,31,34) | UniProtKB/SwissProt
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| 62.4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM81939
 (CAS_52-53-9 | NSC_62969 | VERAPAMIL)Show SMILES COc1ccc(CCN(C)CCCC(C#N)(C(C)C)c2ccc(OC)c(OC)c2)cc1OC Show InChI InChI=1S/C27H38N2O4/c1-20(2)27(19-28,22-10-12-24(31-5)26(18-22)33-7)14-8-15-29(3)16-13-21-9-11-23(30-4)25(17-21)32-6/h9-12,17-18,20H,8,13-16H2,1-7H3 | UniProtKB/SwissProt
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| 66.7 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM82056
 (CAS_4499 | NSC_4499 | Nisoldipine)Show SMILES COC(=O)C1C(C(C(=O)OCC(C)C)=C(C)N=C1C)c1ccccc1[N+]([O-])=O Show InChI InChI=1S/C20H24N2O6/c1-11(2)10-28-20(24)17-13(4)21-12(3)16(19(23)27-5)18(17)14-8-6-7-9-15(14)22(25)26/h6-9,11,16,18H,10H2,1-5H3 | UniProtKB/SwissProt
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| 72 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM50318494
 (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 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 | UniProtKB/SwissProt
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| 80.1 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM50017698
 (4-(4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl)-N,N...)Show SMILES CN(C)C(=O)C(CCN1CCC(O)(CC1)c1ccc(Cl)cc1)(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C29H33ClN2O2/c1-31(2)27(33)29(24-9-5-3-6-10-24,25-11-7-4-8-12-25)19-22-32-20-17-28(34,18-21-32)23-13-15-26(30)16-14-23/h3-16,34H,17-22H2,1-2H3 | UniProtKB/SwissProt
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| 127 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM50334150
 (1-(1-(4,4-bis(4-fluorophenyl)butyl)piperidin-4-yl)...)Show SMILES Fc1ccc(cc1)C(CCCN1CCC(CC1)n1c2ccccc2[nH]c1=O)c1ccc(F)cc1 Show InChI InChI=1S/C28H29F2N3O/c29-22-11-7-20(8-12-22)25(21-9-13-23(30)14-10-21)4-3-17-32-18-15-24(16-19-32)33-27-6-2-1-5-26(27)31-28(33)34/h1-2,5-14,24-25H,3-4,15-19H2,(H,31,34) | UniProtKB/SwissProt
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| 162 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM50336640
 ((nifedipine) 2,6-Dimethyl-4-(2-nitro-phenyl)-1,4-d...)Show SMILES COC(=O)C1C(C(C(=O)OC)=C(C)N=C1C)c1ccccc1[N+]([O-])=O Show InChI InChI=1S/C17H18N2O6/c1-9-13(16(20)24-3)15(14(10(2)18-9)17(21)25-4)11-7-5-6-8-12(11)19(22)23/h5-8,13,15H,1-4H3 | UniProtKB/SwissProt
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| 173 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM23619
 (2-{4-[4,4-bis(4-fluorophenyl)butyl]piperazin-1-yl}...)Show SMILES Cc1cccc(C)c1NC(=O)CN1CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 Show InChI InChI=1S/C30H35F2N3O/c1-22-5-3-6-23(2)30(22)33-29(36)21-35-19-17-34(18-20-35)16-4-7-28(24-8-12-26(31)13-9-24)25-10-14-27(32)15-11-25/h3,5-6,8-15,28H,4,7,16-21H2,1-2H3,(H,33,36) | UniProtKB/SwissProt
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| 188 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM50004704
 ((+)-cis-Diltiazem | (2S,3S)-5-(2-(dimethylamino)et...)Show SMILES COc1ccc(cc1)[C@@H]1Sc2ccccc2N(CCN(C)C)C(=O)[C@@H]1OC(C)=O Show InChI InChI=1S/C22H26N2O4S/c1-15(25)28-20-21(16-9-11-17(27-4)12-10-16)29-19-8-6-5-7-18(19)24(22(20)26)14-13-23(2)3/h5-12,20-21H,13-14H2,1-4H3/t20-,21+/m1/s1 | UniProtKB/SwissProt
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| 195 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM50017698
 (4-(4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl)-N,N...)Show SMILES CN(C)C(=O)C(CCN1CCC(O)(CC1)c1ccc(Cl)cc1)(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C29H33ClN2O2/c1-31(2)27(33)29(24-9-5-3-6-10-24,25-11-7-4-8-12-25)19-22-32-20-17-28(34,18-21-32)23-13-15-26(30)16-14-23/h3-16,34H,17-22H2,1-2H3 | UniProtKB/SwissProt
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| 205 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM78577
 (BEPRIDIL | BEPRIDIL HYDROCHLORIDE | Bepridil | MLS...)Show InChI InChI=1S/C24H34N2O/c1-21(2)19-27-20-24(25-15-9-10-16-25)18-26(23-13-7-4-8-14-23)17-22-11-5-3-6-12-22/h3-8,11-14,21,24H,9-10,15-20H2,1-2H3 | UniProtKB/SwissProt
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| 241 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM50318493
 (3-isopropyl 5-(2-methoxyethyl) 2,6-dimethyl-4-(3-n...)Show SMILES COCCOC(=O)C1=C(C)N=C(C)C(C1c1cccc(c1)[N+]([O-])=O)C(=O)OC(C)C Show InChI InChI=1S/C21H26N2O7/c1-12(2)30-21(25)18-14(4)22-13(3)17(20(24)29-10-9-28-5)19(18)15-7-6-8-16(11-15)23(26)27/h6-8,11-12,18-19H,9-10H2,1-5H3 | UniProtKB/SwissProt
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| 259 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM82060
 (CAS_168089 | NSC_168089 | SKF 24260)Show SMILES CCOC(=O)C1C(C(C(=O)OCC)=C(C)N=C1C)c1ccccc1C(F)(F)F Show InChI InChI=1S/C20H22F3NO4/c1-5-27-18(25)15-11(3)24-12(4)16(19(26)28-6-2)17(15)13-9-7-8-10-14(13)20(21,22)23/h7-10,15,17H,5-6H2,1-4H3 | UniProtKB/SwissProt
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| 268 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM50004704
 ((+)-cis-Diltiazem | (2S,3S)-5-(2-(dimethylamino)et...)Show SMILES COc1ccc(cc1)[C@@H]1Sc2ccccc2N(CCN(C)C)C(=O)[C@@H]1OC(C)=O Show InChI InChI=1S/C22H26N2O4S/c1-15(25)28-20-21(16-9-11-17(27-4)12-10-16)29-19-8-6-5-7-18(19)24(22(20)26)14-13-23(2)3/h5-12,20-21H,13-14H2,1-4H3/t20-,21+/m1/s1 | UniProtKB/SwissProt
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| 281 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM23619
 (2-{4-[4,4-bis(4-fluorophenyl)butyl]piperazin-1-yl}...)Show SMILES Cc1cccc(C)c1NC(=O)CN1CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 Show InChI InChI=1S/C30H35F2N3O/c1-22-5-3-6-23(2)30(22)33-29(36)21-35-19-17-34(18-20-35)16-4-7-28(24-8-12-26(31)13-9-24)25-10-14-27(32)15-11-25/h3,5-6,8-15,28H,4,7,16-21H2,1-2H3,(H,33,36) | UniProtKB/SwissProt
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| 305 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM50017723
 ((3,3-Diphenyl-propyl)-(1-methyl-2-phenyl-ethyl)-am...)Show InChI InChI=1S/C24H27N/c1-20(19-21-11-5-2-6-12-21)25-18-17-24(22-13-7-3-8-14-22)23-15-9-4-10-16-23/h2-16,20,24-25H,17-19H2,1H3 | UniProtKB/SwissProt
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| 320 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM50017723
 ((3,3-Diphenyl-propyl)-(1-methyl-2-phenyl-ethyl)-am...)Show InChI InChI=1S/C24H27N/c1-20(19-21-11-5-2-6-12-21)25-18-17-24(22-13-7-3-8-14-22)23-15-9-4-10-16-23/h2-16,20,24-25H,17-19H2,1H3 | UniProtKB/SwissProt
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| 384 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM50017715
 (CHEMBL125737 | Tiapamil | [2-(3,4-Dimethoxy-phenyl...)Show SMILES COc1ccc(CCN(C)CCCC2(c3ccc(OC)c(OC)c3)S(=O)(=O)CCCS2(=O)=O)cc1OC Show InChI InChI=1S/C26H37NO8S2/c1-27(15-12-20-8-10-22(32-2)24(18-20)34-4)14-6-13-26(36(28,29)16-7-17-37(26,30)31)21-9-11-23(33-3)25(19-21)35-5/h8-11,18-19H,6-7,12-17H2,1-5H3 | UniProtKB/SwissProt
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| 416 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM82059
 (CAS_53421 | Fostedil | NSC_53421)Show InChI InChI=1S/C18H20NO3PS/c1-3-21-23(20,22-4-2)13-14-9-11-15(12-10-14)18-19-16-7-5-6-8-17(16)24-18/h5-12H,3-4,13H2,1-2H3 | UniProtKB/SwissProt
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| 442 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM50002338
 ((Thioridazine)10-[2-(1-Methyl-piperidin-2-yl)-ethy...)Show InChI InChI=1S/C21H26N2S2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(24-2)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3 | UniProtKB/SwissProt
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| 526 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM78577
 (BEPRIDIL | BEPRIDIL HYDROCHLORIDE | Bepridil | MLS...)Show InChI InChI=1S/C24H34N2O/c1-21(2)19-27-20-24(25-15-9-10-16-25)18-26(23-13-7-4-8-14-23)17-22-11-5-3-6-12-22/h3-8,11-14,21,24H,9-10,15-20H2,1-2H3 | UniProtKB/SwissProt
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| 547 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM50002338
 ((Thioridazine)10-[2-(1-Methyl-piperidin-2-yl)-ethy...)Show InChI InChI=1S/C21H26N2S2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(24-2)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3 | UniProtKB/SwissProt
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| 633 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 237: 731-8 (1986)
BindingDB Entry DOI: 10.7270/Q2GT5KP4 |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM50013515
 ((+)-yohimbine | (16alpha,17alpha)-17-hydroxyyohimb...)Show SMILES COC(=O)[C@H]1[C@@H](O)CC[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12 Show InChI InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3/t12-,15-,17-,18-,19+/m0/s1 | UniProtKB/SwissProt
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| 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Marion Merrell Dow Inc.
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 253: 461-5 (1990)
BindingDB Entry DOI: 10.7270/Q2SF2TPW |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM84745
 (CAS_136434-34-9 | DULOXETINE | LY-248686 | LY24868...)Show InChI InChI=1S/C18H19NOS/c1-19-12-11-17(18-10-5-13-21-18)20-16-9-4-7-14-6-2-3-8-15(14)16/h2-10,13,17,19H,11-12H2,1H3/t17-/m0/s1 | UniProtKB/SwissProt
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DrugBank PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by PDSP Ki Database
| |
Neuropsychopharmacology 25: 871-80 (2001)
Article DOI: 10.1016/S0893-133X(01)00298-6 BindingDB Entry DOI: 10.7270/Q25M648W |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM82071
 (CAS_93413-69-5 | CAS_99300-78-4 | NSC_62923 | VENL...)Show InChI InChI=1S/C17H27NO2/c1-18(2)13-16(17(19)11-5-4-6-12-17)14-7-9-15(20-3)10-8-14/h7-10,16,19H,4-6,11-13H2,1-3H3 | UniProtKB/SwissProt
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DrugBank KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly Research Laboratories
Curated by PDSP Ki Database
| |
Neuropsychopharmacology 25: 871-80 (2001)
Article DOI: 10.1016/S0893-133X(01)00298-6 BindingDB Entry DOI: 10.7270/Q25M648W |
More data for this Ligand-Target Pair | |
Calcium channel
(RAT) | BDBM86058
 (MCL0129)Show SMILES COc1ccc2ccccc2c1CCCCN1CCN(C[C@@H](N2CCN(CC2)C(C)C)c2ccc(F)cc2)CC1 Show InChI InChI=1S/C34H47FN4O/c1-27(2)38-22-24-39(25-23-38)33(29-11-14-30(35)15-12-29)26-37-20-18-36(19-21-37)17-7-6-10-32-31-9-5-4-8-28(31)13-16-34(32)40-3/h4-5,8-9,11-16,27,33H,6-7,10,17-26H2,1-3H3/t33-/m1/s1 | UniProtKB/SwissProt
GoogleScholar AffyNet 
| PC cid PC sid UniChem
Similars
| Article PubMed
| 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Taisho Pharmaceutical Co.
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 304: 818-26 (2003)
Article DOI: 10.1124/jpet.102.044826 BindingDB Entry DOI: 10.7270/Q2FQ9V5W |
More data for this Ligand-Target Pair | |