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Compile Data Set for Download or QSAR

Found 124 hits with Last Name = 'quan' and Initial = 'a'   
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
Dynamin-1


(Homo sapiens (Human))
BDBM5149
PNG
((2E)-2-cyano-N-{3-[(2E)-2-cyano-3-(3,4-dihydroxyph...)
Show SMILES Oc1ccc(\C=C(/C#N)C(=O)NCCCNC(=O)C(=C\c2ccc(O)c(O)c2)\C#N)cc1O
Show InChI InChI=1S/C23H20N4O6/c24-12-16(8-14-2-4-18(28)20(30)10-14)22(32)26-6-1-7-27-23(33)17(13-25)9-15-3-5-19(29)21(31)11-15/h2-5,8-11,28-31H,1,6-7H2,(H,26,32)(H,27,33)/b16-8+,17-9+
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n/an/a 1.70E+3n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Inhibitory activity against dynamin1 GTPase expressed in sheep brain


J Med Chem 48: 7781-8 (2005)


Article DOI: 10.1021/jm040208l
BindingDB Entry DOI: 10.7270/Q2BC3Z41
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50177941
PNG
(2-cyano-N-{3-[2-cyano-3-(3,4,5-trihydroxyphenyl)ac...)
Show SMILES Oc1cc(\C=C(/C#N)C(=O)NCCNC(=O)C(=C\c2cc(O)c(O)c(O)c2)\C#N)cc(O)c1O
Show InChI InChI=1S/C22H18N4O8/c23-9-13(3-11-5-15(27)19(31)16(28)6-11)21(33)25-1-2-26-22(34)14(10-24)4-12-7-17(29)20(32)18(30)8-12/h3-8,27-32H,1-2H2,(H,25,33)(H,26,34)/b13-3+,14-4+
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n/an/a 1.70E+3n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Inhibitory activity against dynamin1 GTPase expressed in sheep brain


J Med Chem 48: 7781-8 (2005)


Article DOI: 10.1021/jm040208l
BindingDB Entry DOI: 10.7270/Q2BC3Z41
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50177923
PNG
(2-cyano-N-{3-[2-cyano-3-(3,4,5-trihydroxyphenyl)ac...)
Show SMILES Oc1cc(\C=C(/C#N)C(=O)NCCCCCNC(=O)C(=C\c2cc(O)c(O)c(O)c2)\C#N)cc(O)c1O
Show InChI InChI=1S/C25H24N4O8/c26-12-16(6-14-8-18(30)22(34)19(31)9-14)24(36)28-4-2-1-3-5-29-25(37)17(13-27)7-15-10-20(32)23(35)21(33)11-15/h6-11,30-35H,1-5H2,(H,28,36)(H,29,37)/b16-6+,17-7+
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n/an/a 1.70E+3n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Inhibitory activity against dynamin1 GTPase expressed in sheep brain


J Med Chem 48: 7781-8 (2005)


Article DOI: 10.1021/jm040208l
BindingDB Entry DOI: 10.7270/Q2BC3Z41
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50177937
PNG
(2-cyano-N-{3-[2-cyano-3-(3,4,5-trihydroxyphenyl)ac...)
Show SMILES Oc1cc(\C=C(/C#N)C(=O)NCCCNC(=O)C(=C\c2cc(O)c(O)c(O)c2)\C#N)cc(O)c1O
Show InChI InChI=1S/C23H20N4O8/c24-10-14(4-12-6-16(28)20(32)17(29)7-12)22(34)26-2-1-3-27-23(35)15(11-25)5-13-8-18(30)21(33)19(31)9-13/h4-9,28-33H,1-3H2,(H,26,34)(H,27,35)/b14-4+,15-5+
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n/an/a 1.70E+3n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Inhibitory activity against dynamin1 GTPase expressed in sheep brain


J Med Chem 48: 7781-8 (2005)


Article DOI: 10.1021/jm040208l
BindingDB Entry DOI: 10.7270/Q2BC3Z41
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM5152
PNG
((2E)-2-cyano-N-{4-[(2E)-2-cyano-3-(3,4,5-trihydrox...)
Show SMILES Oc1cc(\C=C(/C#N)C(=O)NCCCCNC(=O)C(=C\c2cc(O)c(O)c(O)c2)\C#N)cc(O)c1O
Show InChI InChI=1S/C24H22N4O8/c25-11-15(5-13-7-17(29)21(33)18(30)8-13)23(35)27-3-1-2-4-28-24(36)16(12-26)6-14-9-19(31)22(34)20(32)10-14/h5-10,29-34H,1-4H2,(H,27,35)(H,28,36)/b15-5+,16-6+
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n/an/a 2.10E+3n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Inhibitory activity against dynamin1 GTPase expressed in sheep brain


J Med Chem 48: 7781-8 (2005)


Article DOI: 10.1021/jm040208l
BindingDB Entry DOI: 10.7270/Q2BC3Z41
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50147563
PNG
(CHEMBL109458 | Trimethyl-octadecyl-ammonium; bromi...)
Show SMILES CCCCCCCCCCCCCCCCCC[N+](C)(C)C
Show InChI InChI=1S/C21H46N/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(2,3)4/h5-21H2,1-4H3/q+1
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n/an/a 3.15E+3n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Concentration required against dynamin-1 GTPase activity of sheep brain.


Bioorg Med Chem Lett 14: 3275-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.096
BindingDB Entry DOI: 10.7270/Q27M07CT
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM5151
PNG
((2E)-2-cyano-N-{4-[(2E)-2-cyano-3-(3,4-dihydroxyph...)
Show SMILES Oc1ccc(\C=C(/C#N)C(=O)NCCCCNC(=O)C(=C\c2ccc(O)c(O)c2)\C#N)cc1O
Show InChI InChI=1S/C24H22N4O6/c25-13-17(9-15-3-5-19(29)21(31)11-15)23(33)27-7-1-2-8-28-24(34)18(14-26)10-16-4-6-20(30)22(32)12-16/h3-6,9-12,29-32H,1-2,7-8H2,(H,27,33)(H,28,34)/b17-9+,18-10+
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n/an/a 3.20E+3n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Inhibitory activity against dynamin1 GTPase expressed in sheep brain


J Med Chem 48: 7781-8 (2005)


Article DOI: 10.1021/jm040208l
BindingDB Entry DOI: 10.7270/Q2BC3Z41
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM58941
PNG
(CHEMBL307346 | Hexadecyltrimethylammonium hydroxid...)
Show SMILES CCCCCCCCCCCCCCCC[N+](C)(C)C
Show InChI InChI=1S/C19H42N/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(2,3)4/h5-19H2,1-4H3/q+1
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n/an/a 4.37E+3n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Concentration required against dynamin-1 GTPase activity of sheep brain.


Bioorg Med Chem Lett 14: 3275-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.096
BindingDB Entry DOI: 10.7270/Q27M07CT
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50177943
PNG
(2-cyano-N-{3-[2-cyano-3-(3,4-dihydroxy-5-methoxyph...)
Show SMILES COc1cc(\C=C(/C#N)C(=O)NCCCNC(=O)C(=C\c2cc(O)c(O)c(OC)c2)\C#N)cc(O)c1O
Show InChI InChI=1S/C25H24N4O8/c1-36-20-10-14(8-18(30)22(20)32)6-16(12-26)24(34)28-4-3-5-29-25(35)17(13-27)7-15-9-19(31)23(33)21(11-15)37-2/h6-11,30-33H,3-5H2,1-2H3,(H,28,34)(H,29,35)/b16-6+,17-7+
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n/an/a 5.00E+3n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Inhibitory activity against dynamin1 GTPase expressed in sheep brain


J Med Chem 48: 7781-8 (2005)


Article DOI: 10.1021/jm040208l
BindingDB Entry DOI: 10.7270/Q2BC3Z41
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM5153
PNG
((2E)-2-cyano-N-{5-[(2E)-2-cyano-3-(3,4-dihydroxyph...)
Show SMILES Oc1ccc(\C=C(/C#N)C(=O)NCCCCCNC(=O)C(=C\c2ccc(O)c(O)c2)\C#N)cc1O
Show InChI InChI=1S/C25H24N4O6/c26-14-18(10-16-4-6-20(30)22(32)12-16)24(34)28-8-2-1-3-9-29-25(35)19(15-27)11-17-5-7-21(31)23(33)13-17/h4-7,10-13,30-33H,1-3,8-9H2,(H,28,34)(H,29,35)/b18-10+,19-11+
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n/an/a 5.00E+3n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Inhibitory activity against dynamin1 GTPase expressed in sheep brain


J Med Chem 48: 7781-8 (2005)


Article DOI: 10.1021/jm040208l
BindingDB Entry DOI: 10.7270/Q2BC3Z41
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50268295
PNG
(2-Cyano-N-octyl-3-(1-(3-dimethylaminopropyl)-1H-in...)
Show SMILES CCCCCCCCNC(=O)C(=C\c1cn(CCCN(C)C)c2ccccc12)\C#N
Show InChI InChI=1S/C25H36N4O/c1-4-5-6-7-8-11-15-27-25(30)21(19-26)18-22-20-29(17-12-16-28(2)3)24-14-10-9-13-23(22)24/h9-10,13-14,18,20H,4-8,11-12,15-17H2,1-3H3,(H,27,30)/b21-18+
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n/an/a 5.00E+3n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Inhibition of dynamin 1-mediated endocytosis internalization of Tf-A594 in human U2OS cells pretreated for 30 mins


J Med Chem 52: 3762-73 (2009)


Article DOI: 10.1021/jm900036m
BindingDB Entry DOI: 10.7270/Q28W3D79
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM5150
PNG
((2E)-2-cyano-N-{2-[(2E)-2-cyano-3-(3,4-dihydroxyph...)
Show SMILES Oc1ccc(\C=C(/C#N)C(=O)NCCNC(=O)C(=C\c2ccc(O)c(O)c2)\C#N)cc1O
Show InChI InChI=1S/C22H18N4O6/c23-11-15(7-13-1-3-17(27)19(29)9-13)21(31)25-5-6-26-22(32)16(12-24)8-14-2-4-18(28)20(30)10-14/h1-4,7-10,27-30H,5-6H2,(H,25,31)(H,26,32)/b15-7+,16-8+
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n/an/a 5.10E+3n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Inhibitory activity against dynamin1 GTPase expressed in sheep brain


J Med Chem 48: 7781-8 (2005)


Article DOI: 10.1021/jm040208l
BindingDB Entry DOI: 10.7270/Q2BC3Z41
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50177940
PNG
(2-cyano-N-{3-[2-cyano-3-(3,4-dihydroxyphenyl)acryl...)
Show SMILES OC(CNC(=O)C(=C\c1ccc(O)c(O)c1)\C#N)CNC(=O)C(=C\c1ccc(O)c(O)c1)\C#N
Show InChI InChI=1S/C23H20N4O7/c24-9-15(5-13-1-3-18(29)20(31)7-13)22(33)26-11-17(28)12-27-23(34)16(10-25)6-14-2-4-19(30)21(32)8-14/h1-8,17,28-32H,11-12H2,(H,26,33)(H,27,34)/b15-5+,16-6+
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n/an/a 5.10E+3n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Inhibitory activity against dynamin1 GTPase expressed in sheep brain


J Med Chem 48: 7781-8 (2005)


Article DOI: 10.1021/jm040208l
BindingDB Entry DOI: 10.7270/Q2BC3Z41
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50060597
PNG
(CHEMBL109747 | CHEMBL113150 | CHEMBL325636 | Cetri...)
Show SMILES CCCCCCCCCCCCCC[N+](C)(C)C
Show InChI InChI=1S/C17H38N/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18(2,3)4/h5-17H2,1-4H3/q+1
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n/an/a 5.79E+3n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Concentration required against dynamin-1 GTPase activity of sheep brain.


Bioorg Med Chem Lett 14: 3275-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.096
BindingDB Entry DOI: 10.7270/Q27M07CT
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50177965
PNG
(2-cyano-N-{3-[-2-cyano-3-(3,4,5-trihydroxyphenyl)a...)
Show SMILES Oc1cc(\C=C(/C#N)C(=O)NCCCCCCNC(=O)C(=C\c2cc(O)c(O)c(O)c2)\C#N)cc(O)c1O
Show InChI InChI=1S/C26H26N4O8/c27-13-17(7-15-9-19(31)23(35)20(32)10-15)25(37)29-5-3-1-2-4-6-30-26(38)18(14-28)8-16-11-21(33)24(36)22(34)12-16/h7-12,31-36H,1-6H2,(H,29,37)(H,30,38)/b17-7+,18-8+
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n/an/a 6.00E+3n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Inhibitory activity against dynamin1 GTPase expressed in sheep brain


J Med Chem 48: 7781-8 (2005)


Article DOI: 10.1021/jm040208l
BindingDB Entry DOI: 10.7270/Q2BC3Z41
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50147557
PNG
(2-Tetradecyloxy-propane-1,3-diammonium chloride | ...)
Show SMILES CCCCCCCCCCCCCCOC(C[NH3+])C[NH3+]
Show InChI InChI=1S/C17H38N2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-20-17(15-18)16-19/h17H,2-16,18-19H2,1H3/p+2
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n/an/a 7.37E+3n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Concentration required against dynamin-1 GTPase activity of sheep brain.


Bioorg Med Chem Lett 14: 3275-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.096
BindingDB Entry DOI: 10.7270/Q27M07CT
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50147573
PNG
(CHEMBL112857 | Tridecanoic acid (3-dimethylamino-p...)
Show SMILES CCCCCCCCCCCCC(=O)NCCCN(C)C
Show InChI InChI=1S/C18H38N2O/c1-4-5-6-7-8-9-10-11-12-13-15-18(21)19-16-14-17-20(2)3/h4-17H2,1-3H3,(H,19,21)
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n/an/a 7.75E+3n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Concentration required against dynamin-1 GTPase activity of sheep brain.


Bioorg Med Chem Lett 14: 3275-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.096
BindingDB Entry DOI: 10.7270/Q27M07CT
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50177973
PNG
(2-cyano-N-{3-[2-cyano-3-(3,4-dihydroxy-5-methoxyph...)
Show SMILES COc1cc(\C=C(/C#N)C(=O)NCCCCNC(=O)C(=C\c2cc(O)c(O)c(OC)c2)\C#N)cc(O)c1O
Show InChI InChI=1S/C26H26N4O8/c1-37-21-11-15(9-19(31)23(21)33)7-17(13-27)25(35)29-5-3-4-6-30-26(36)18(14-28)8-16-10-20(32)24(34)22(12-16)38-2/h7-12,31-34H,3-6H2,1-2H3,(H,29,35)(H,30,36)/b17-7+,18-8+
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n/an/a 8.00E+3n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Inhibitory activity against dynamin1 GTPase expressed in sheep brain


J Med Chem 48: 7781-8 (2005)


Article DOI: 10.1021/jm040208l
BindingDB Entry DOI: 10.7270/Q2BC3Z41
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50177944
PNG
(2-cyano-N-{3-[2-cyano-3-(3,4-dihydroxy-5-methoxyph...)
Show SMILES COc1cc(\C=C(/C#N)C(=O)NCCCCCNC(=O)C(=C\c2cc(O)c(O)c(OC)c2)\C#N)cc(O)c1O
Show InChI InChI=1S/C27H28N4O8/c1-38-22-12-16(10-20(32)24(22)34)8-18(14-28)26(36)30-6-4-3-5-7-31-27(37)19(15-29)9-17-11-21(33)25(35)23(13-17)39-2/h8-13,32-35H,3-7H2,1-2H3,(H,30,36)(H,31,37)/b18-8+,19-9+
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n/an/a 8.00E+3n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Inhibitory activity against dynamin1 GTPase expressed in sheep brain


J Med Chem 48: 7781-8 (2005)


Article DOI: 10.1021/jm040208l
BindingDB Entry DOI: 10.7270/Q2BC3Z41
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50147576
PNG
(Butyl-dimethyl-tetradecyl-ammonium; bromide | CHEM...)
Show SMILES CCCCCCCCCCCCCC[N+](C)(C)CCCC
Show InChI InChI=1S/C20H44N/c1-5-7-9-10-11-12-13-14-15-16-17-18-20-21(3,4)19-8-6-2/h5-20H2,1-4H3/q+1
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n/an/a 8.02E+3n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Concentration required against dynamin-1 GTPase activity of sheep brain.


Bioorg Med Chem Lett 14: 3275-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.096
BindingDB Entry DOI: 10.7270/Q27M07CT
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50060597
PNG
(CHEMBL109747 | CHEMBL113150 | CHEMBL325636 | Cetri...)
Show SMILES CCCCCCCCCCCCCC[N+](C)(C)C
Show InChI InChI=1S/C17H38N/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18(2,3)4/h5-17H2,1-4H3/q+1
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n/an/a 8.15E+3n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Concentration required against dynamin-1 GTPase activity of sheep brain.


Bioorg Med Chem Lett 14: 3275-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.096
BindingDB Entry DOI: 10.7270/Q27M07CT
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50147577
PNG
(CHEMBL109914 | Triethyl-tetradecyl-ammonium; bromi...)
Show SMILES CCCCCCCCCCCCCC[N+](CC)(CC)CC
Show InChI InChI=1S/C20H44N/c1-5-9-10-11-12-13-14-15-16-17-18-19-20-21(6-2,7-3)8-4/h5-20H2,1-4H3/q+1
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n/an/a 8.45E+3n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Concentration required against dynamin-1 GTPase activity of sheep brain.


Bioorg Med Chem Lett 14: 3275-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.096
BindingDB Entry DOI: 10.7270/Q27M07CT
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50147559
PNG
(CHEMBL110310 | CHEMBL325871 | Tetradecyl-ammonium;...)
Show SMILES CCCCCCCCCCCCCC[NH3+]
Show InChI InChI=1S/C14H31N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h2-15H2,1H3/p+1
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n/an/a 8.74E+3n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Concentration required against dynamin-1 GTPase activity of sheep brain.


Bioorg Med Chem Lett 14: 3275-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.096
BindingDB Entry DOI: 10.7270/Q27M07CT
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50147553
PNG
(CHEMBL109566 | Dimethyl-propyl-tetradecyl-ammonium...)
Show SMILES CCCCCCCCCCCCCC[N+](C)(C)CCC
Show InChI InChI=1S/C19H42N/c1-5-7-8-9-10-11-12-13-14-15-16-17-19-20(3,4)18-6-2/h5-19H2,1-4H3/q+1
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n/an/a 8.85E+3n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Concentration required against dynamin-1 GTPase activity of sheep brain.


Bioorg Med Chem Lett 14: 3275-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.096
BindingDB Entry DOI: 10.7270/Q27M07CT
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50147572
PNG
(CHEMBL321384 | Tridecanoic acid (2-dimethylamino-e...)
Show SMILES CCCCCCCCCCCCC(=O)NCCN(C)C
Show InChI InChI=1S/C17H36N2O/c1-4-5-6-7-8-9-10-11-12-13-14-17(20)18-15-16-19(2)3/h4-16H2,1-3H3,(H,18,20)
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n/an/a 8.85E+3n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Concentration required against dynamin-1 GTPase activity of sheep brain.


Bioorg Med Chem Lett 14: 3275-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.096
BindingDB Entry DOI: 10.7270/Q27M07CT
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50177955
PNG
(2-cyano-N-{3-[2-cyano-3-(3,4-dihydroxy-5-methoxyph...)
Show SMILES COc1cc(\C=C(/C#N)C(=O)NCCNC(=O)C(=C\c2cc(O)c(O)c(OC)c2)\C#N)cc(O)c1O
Show InChI InChI=1S/C24H22N4O8/c1-35-19-9-13(7-17(29)21(19)31)5-15(11-25)23(33)27-3-4-28-24(34)16(12-26)6-14-8-18(30)22(32)20(10-14)36-2/h5-10,29-32H,3-4H2,1-2H3,(H,27,33)(H,28,34)/b15-5+,16-6+
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n/an/a 9.00E+3n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Inhibitory activity against dynamin1 GTPase expressed in sheep brain


J Med Chem 48: 7781-8 (2005)


Article DOI: 10.1021/jm040208l
BindingDB Entry DOI: 10.7270/Q2BC3Z41
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50060550
PNG
((2-Hydroxy-ethyl)-dimethyl-tetradecyl-ammonium; br...)
Show SMILES CCCCCCCCCCCCCC[N+](C)(C)CCO
Show InChI InChI=1S/C18H40NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19(2,3)17-18-20/h20H,4-18H2,1-3H3/q+1
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n/an/a 9.36E+3n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Concentration required against dynamin-1 GTPase activity of sheep brain.


Bioorg Med Chem Lett 14: 3275-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.096
BindingDB Entry DOI: 10.7270/Q27M07CT
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50084931
PNG
(CHEMBL110737 | Triethyl-hexadecyl-ammonium; bromid...)
Show SMILES CCCCCCCCCCCCCCCC[N+](CC)(CC)CC
Show InChI InChI=1S/C22H48N/c1-5-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(6-2,7-3)8-4/h5-22H2,1-4H3/q+1
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n/an/a 9.62E+3n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Concentration required against dynamin-1 GTPase activity of sheep brain.


Bioorg Med Chem Lett 14: 3275-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.096
BindingDB Entry DOI: 10.7270/Q27M07CT
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50060597
PNG
(CHEMBL109747 | CHEMBL113150 | CHEMBL325636 | Cetri...)
Show SMILES CCCCCCCCCCCCCC[N+](C)(C)C
Show InChI InChI=1S/C17H38N/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18(2,3)4/h5-17H2,1-4H3/q+1
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n/an/a 9.68E+3n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Concentration required against dynamin-1 GTPase activity of sheep brain.


Bioorg Med Chem Lett 14: 3275-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.096
BindingDB Entry DOI: 10.7270/Q27M07CT
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50060580
PNG
(CHEMBL324402 | Dodecyl-ethyl-dimethyl-ammonium; br...)
Show SMILES CCCCCCCCCCCC[N+](C)(C)CC
Show InChI InChI=1S/C16H36N/c1-5-7-8-9-10-11-12-13-14-15-16-17(3,4)6-2/h5-16H2,1-4H3/q+1
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n/an/a 1.01E+4n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Concentration required against dynamin-1 GTPase activity of sheep brain.


Bioorg Med Chem Lett 14: 3275-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.096
BindingDB Entry DOI: 10.7270/Q27M07CT
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50147569
PNG
(CHEMBL112909 | Tetradecanoic acid (2-amino-1-amino...)
Show SMILES CCCCCCCCCCCCCC(=O)NC(C[NH3+])C[NH3+]
Show InChI InChI=1S/C17H37N3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-17(21)20-16(14-18)15-19/h16H,2-15,18-19H2,1H3,(H,20,21)/p+2
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n/an/a 1.02E+4n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Concentration required against dynamin-1 GTPase activity of sheep brain.


Bioorg Med Chem Lett 14: 3275-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.096
BindingDB Entry DOI: 10.7270/Q27M07CT
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50147565
PNG
(CHEMBL110738 | Tributyl-hexadecyl-phosphonium; bro...)
Show SMILES CCCCCCCCCCCCCCCC[P+](CCCC)(CCCC)CCCC
Show InChI InChI=1S/C28H60P/c1-5-9-13-14-15-16-17-18-19-20-21-22-23-24-28-29(25-10-6-2,26-11-7-3)27-12-8-4/h5-28H2,1-4H3/q+1
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n/an/a 1.02E+4n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Concentration required against dynamin-1 GTPase activity of sheep brain.


Bioorg Med Chem Lett 14: 3275-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.096
BindingDB Entry DOI: 10.7270/Q27M07CT
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50268962
PNG
(2-Cyano-N-octyl-3-[1-(3-dimethylaminopropyl)-2-met...)
Show SMILES CCCCCCCCNC(=O)C(=C\c1c(C)n(CCCN(C)C)c2ccccc12)\C#N
Show InChI InChI=1S/C26H38N4O/c1-5-6-7-8-9-12-16-28-26(31)22(20-27)19-24-21(2)30(18-13-17-29(3)4)25-15-11-10-14-23(24)25/h10-11,14-15,19H,5-9,12-13,16-18H2,1-4H3,(H,28,31)/b22-19+
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n/an/a 1.08E+4n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Inhibition of dynamin 1-mediated endocytosis internalization of Tf-A594 in human U2OS cells pretreated for 30 mins


J Med Chem 52: 3762-73 (2009)


Article DOI: 10.1021/jm900036m
BindingDB Entry DOI: 10.7270/Q28W3D79
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50147554
PNG
(CHEMBL109904 | Dodecylamine)
Show SMILES CCCCCCCCCCCCN
Show InChI InChI=1S/C12H27N/c1-2-3-4-5-6-7-8-9-10-11-12-13/h2-13H2,1H3
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n/an/a 1.29E+4n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Concentration required against dynamin-1 GTPase activity of sheep brain.


Bioorg Med Chem Lett 14: 3275-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.096
BindingDB Entry DOI: 10.7270/Q27M07CT
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50268872
PNG
(2-Cyano-N-octyl-3-[1-(2-dimethylaminoethyl)-2-meth...)
Show SMILES CCCCCCCCNC(=O)C(=C\c1c(C)n(CCN(C)C)c2ccccc12)\C#N
Show InChI InChI=1S/C25H36N4O/c1-5-6-7-8-9-12-15-27-25(30)21(19-26)18-23-20(2)29(17-16-28(3)4)24-14-11-10-13-22(23)24/h10-11,13-14,18H,5-9,12,15-17H2,1-4H3,(H,27,30)/b21-18+
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n/an/a 1.32E+4n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Inhibition of dynamin 1-mediated endocytosis internalization of Tf-A594 in human U2OS cells pretreated for 30 mins


J Med Chem 52: 3762-73 (2009)


Article DOI: 10.1021/jm900036m
BindingDB Entry DOI: 10.7270/Q28W3D79
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50268961
PNG
(2-Cyano-N-hexyl-3-[1-(3-dimethylaminopropyl)-2-met...)
Show SMILES CCCCCCNC(=O)C(=C\c1c(C)n(CCCN(C)C)c2ccccc12)\C#N
Show InChI InChI=1S/C24H34N4O/c1-5-6-7-10-14-26-24(29)20(18-25)17-22-19(2)28(16-11-15-27(3)4)23-13-9-8-12-21(22)23/h8-9,12-13,17H,5-7,10-11,14-16H2,1-4H3,(H,26,29)/b20-17+
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n/an/a 1.43E+4n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Inhibition of dynamin 1-mediated endocytosis internalization of Tf-A594 in human U2OS cells pretreated for 30 mins


J Med Chem 52: 3762-73 (2009)


Article DOI: 10.1021/jm900036m
BindingDB Entry DOI: 10.7270/Q28W3D79
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50147570
PNG
(CHEMBL109737 | Dodecyl-dimethyl-amine | N,N-dimeth...)
Show SMILES CCCCCCCCCCCCN(C)C
Show InChI InChI=1S/C14H31N/c1-4-5-6-7-8-9-10-11-12-13-14-15(2)3/h4-14H2,1-3H3
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n/an/a 1.48E+4n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Concentration required against dynamin-1 GTPase activity of sheep brain.


Bioorg Med Chem Lett 14: 3275-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.096
BindingDB Entry DOI: 10.7270/Q27M07CT
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50147559
PNG
(CHEMBL110310 | CHEMBL325871 | Tetradecyl-ammonium;...)
Show SMILES CCCCCCCCCCCCCC[NH3+]
Show InChI InChI=1S/C14H31N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h2-15H2,1H3/p+1
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n/an/a 1.49E+4n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Concentration required against dynamin-1 GTPase activity of sheep brain.


Bioorg Med Chem Lett 14: 3275-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.096
BindingDB Entry DOI: 10.7270/Q27M07CT
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50060599
PNG
(CHEMBL109873 | Dodecyl-trimethyl-ammonium; bromide)
Show SMILES CCCCCCCCCCCC[N+](C)(C)C
Show InChI InChI=1S/C15H34N/c1-5-6-7-8-9-10-11-12-13-14-15-16(2,3)4/h5-15H2,1-4H3/q+1
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n/an/a 1.63E+4n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Concentration required against dynamin-1 GTPase activity of sheep brain.


Bioorg Med Chem Lett 14: 3275-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.096
BindingDB Entry DOI: 10.7270/Q27M07CT
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50147568
PNG
(CHEMBL113050 | Dodecyl-ammonium; chloride)
Show SMILES CCCCCCCCCCCC[NH3+]
Show InChI InChI=1S/C12H27N/c1-2-3-4-5-6-7-8-9-10-11-12-13/h2-13H2,1H3/p+1
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n/an/a 1.82E+4n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Concentration required against dynamin-1 GTPase activity of sheep brain.


Bioorg Med Chem Lett 14: 3275-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.096
BindingDB Entry DOI: 10.7270/Q27M07CT
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50147575
PNG
(Benzyl-dimethyl-tetradecyl-ammonium; bromide | CHE...)
Show SMILES CCCCCCCCCCCCCC[N+](C)(C)Cc1ccccc1
Show InChI InChI=1S/C23H42N/c1-4-5-6-7-8-9-10-11-12-13-14-18-21-24(2,3)22-23-19-16-15-17-20-23/h15-17,19-20H,4-14,18,21-22H2,1-3H3/q+1
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n/an/a 1.96E+4n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Concentration required against dynamin-1 GTPase activity of sheep brain.


Bioorg Med Chem Lett 14: 3275-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.096
BindingDB Entry DOI: 10.7270/Q27M07CT
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50147580
PNG
(CHEMBL110011 | Tetradecylamine)
Show SMILES CCCCCCCCCCCCCCN
Show InChI InChI=1S/C14H31N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h2-15H2,1H3
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n/an/a 2.03E+4n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Concentration required against dynamin-1 GTPase activity of sheep brain.


Bioorg Med Chem Lett 14: 3275-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.096
BindingDB Entry DOI: 10.7270/Q27M07CT
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50147571
PNG
(CHEMBL113357 | Tridecanoic acid 2-dimethylamino-et...)
Show SMILES CCCCCCCCCCCCC(=O)OCCN(C)C
Show InChI InChI=1S/C17H35NO2/c1-4-5-6-7-8-9-10-11-12-13-14-17(19)20-16-15-18(2)3/h4-16H2,1-3H3
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n/an/a 2.30E+4n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Concentration required against dynamin-1 GTPase activity of sheep brain.


Bioorg Med Chem Lett 14: 3275-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.096
BindingDB Entry DOI: 10.7270/Q27M07CT
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM5154
PNG
((2E)-2-cyano-N-{6-[(2E)-2-cyano-3-(3,4-dihydroxyph...)
Show SMILES Oc1ccc(\C=C(/C#N)C(=O)NCCCCCCNC(=O)C(=C\c2ccc(O)c(O)c2)\C#N)cc1O
Show InChI InChI=1S/C26H26N4O6/c27-15-19(11-17-5-7-21(31)23(33)13-17)25(35)29-9-3-1-2-4-10-30-26(36)20(16-28)12-18-6-8-22(32)24(34)14-18/h5-8,11-14,31-34H,1-4,9-10H2,(H,29,35)(H,30,36)/b19-11+,20-12+
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PubMed
n/an/a 2.60E+4n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Inhibitory activity against dynamin1 GTPase expressed in sheep brain


J Med Chem 48: 7781-8 (2005)


Article DOI: 10.1021/jm040208l
BindingDB Entry DOI: 10.7270/Q2BC3Z41
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50147579
PNG
(CHEMBL55860 | OCTADECYLAMINE | Stearamine)
Show SMILES CCCCCCCCCCCCCCCCCCN
Show InChI InChI=1S/C18H39N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h2-19H2,1H3
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n/an/a 2.82E+4n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Concentration required against dynamin-1 GTPase activity of sheep brain.


Bioorg Med Chem Lett 14: 3275-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.096
BindingDB Entry DOI: 10.7270/Q27M07CT
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50147552
PNG
(CHEMBL112826 | CHEMBL112888 | Dodecyl-dimethyl-amm...)
Show SMILES CCCCCCCCCCCC[NH+](C)C
Show InChI InChI=1S/C14H31N/c1-4-5-6-7-8-9-10-11-12-13-14-15(2)3/h4-14H2,1-3H3/p+1
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PubMed
n/an/a 3.00E+4n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Concentration required against dynamin-1 GTPase activity of sheep brain.


Bioorg Med Chem Lett 14: 3275-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.096
BindingDB Entry DOI: 10.7270/Q27M07CT
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50147562
PNG
(CHEMBL114402 | CHEMBL331817 | Octadecyl-ammonium; ...)
Show SMILES CCCCCCCCCCCCCCCCCC[NH3+]
Show InChI InChI=1S/C18H39N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h2-19H2,1H3/p+1
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PubMed
n/an/a 3.11E+4n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Concentration required against dynamin-1 GTPase activity of sheep brain.


Bioorg Med Chem Lett 14: 3275-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.096
BindingDB Entry DOI: 10.7270/Q27M07CT
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50147566
PNG
(CHEMBL109819 | Decylamine)
Show SMILES CCCCCCCCCCN
Show InChI InChI=1S/C10H23N/c1-2-3-4-5-6-7-8-9-10-11/h2-11H2,1H3
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n/an/a 3.35E+4n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Concentration required against dynamin-1 GTPase activity of sheep brain.


Bioorg Med Chem Lett 14: 3275-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.096
BindingDB Entry DOI: 10.7270/Q27M07CT
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50147552
PNG
(CHEMBL112826 | CHEMBL112888 | Dodecyl-dimethyl-amm...)
Show SMILES CCCCCCCCCCCC[NH+](C)C
Show InChI InChI=1S/C14H31N/c1-4-5-6-7-8-9-10-11-12-13-14-15(2)3/h4-14H2,1-3H3/p+1
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Article
PubMed
n/an/a 3.38E+4n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Concentration required against dynamin-1 GTPase activity of sheep brain.


Bioorg Med Chem Lett 14: 3275-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.096
BindingDB Entry DOI: 10.7270/Q27M07CT
More data for this
Ligand-Target Pair
Dynamin-1


(Homo sapiens (Human))
BDBM50177950
PNG
(2-cyano-3-(3,4-dihydroxyphenyl)acrylic acid 2-[2-c...)
Show SMILES Oc1ccc(\C=C(/C#N)C(=O)OCCCOC(=O)C(=C\c2ccc(O)c(O)c2)\C#N)cc1O
Show InChI InChI=1S/C23H18N2O8/c24-12-16(8-14-2-4-18(26)20(28)10-14)22(30)32-6-1-7-33-23(31)17(13-25)9-15-3-5-19(27)21(29)11-15/h2-5,8-11,26-29H,1,6-7H2/b16-8+,17-9+
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Article
PubMed
n/an/a 3.80E+4n/an/an/an/an/an/a



The University of Newcastle

Curated by ChEMBL


Assay Description
Inhibitory activity against dynamin1 GTPase expressed in sheep brain


J Med Chem 48: 7781-8 (2005)


Article DOI: 10.1021/jm040208l
BindingDB Entry DOI: 10.7270/Q2BC3Z41
More data for this
Ligand-Target Pair
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