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Compile Data Set for Download or QSAR

Found 15 hits of ic50 for UniProtKB: P02550   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Tubulin alpha-1A/beta chain


(Sus scrofa (Pig))
BDBM50095321
PNG
(2-Methoxy-5-(3,4,5-trimethoxy-benzyloxy)-benzaldeh...)
Show SMILES COc1ccc(OCc2cc(OC)c(OC)c(OC)c2)cc1C=O
Show InChI InChI=1S/C18H20O6/c1-20-15-6-5-14(9-13(15)10-19)24-11-12-7-16(21-2)18(23-4)17(8-12)22-3/h5-10H,11H2,1-4H3
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n/an/a 600n/an/an/an/an/an/a



The University of Manchester

Curated by ChEMBL


Assay Description
Effect on tubulin binding and the concentration required to cause 50% decrease in tubulin assembly at 350 nm.


Bioorg Med Chem Lett 11: 51-4 (2001)


BindingDB Entry DOI: 10.7270/Q2C82CHT
More data for this
Ligand-Target Pair
Tubulin alpha-1A/beta chain


(Sus scrofa (Pig))
BDBM50135466
PNG
(CHEMBL3752997)
Show SMILES COc1cc(cc(OC)c1OC)-c1n[nH]nc1-c1cc2ccccc2s1
Show InChI InChI=1S/C19H17N3O3S/c1-23-13-8-12(9-14(24-2)19(13)25-3)17-18(21-22-20-17)16-10-11-6-4-5-7-15(11)26-16/h4-10H,1-3H3,(H,20,21,22)
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n/an/a 1.70E+3n/an/an/an/an/an/a



University of Arkansas for Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of porcine brain tubulin polymerization by spectrophotometric analysis


Medchemcomm 6: 1535-1543 (2016)


BindingDB Entry DOI: 10.7270/Q2H41T8J
More data for this
Ligand-Target Pair
Tubulin alpha-1A/beta chain


(Sus scrofa (Pig))
BDBM50095321
PNG
(2-Methoxy-5-(3,4,5-trimethoxy-benzyloxy)-benzaldeh...)
Show SMILES COc1ccc(OCc2cc(OC)c(OC)c(OC)c2)cc1C=O
Show InChI InChI=1S/C18H20O6/c1-20-15-6-5-14(9-13(15)10-19)24-11-12-7-16(21-2)18(23-4)17(8-12)22-3/h5-10H,11H2,1-4H3
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n/an/a 4.00E+3n/an/an/an/an/an/a



The University of Manchester

Curated by ChEMBL


Assay Description
Concentration required to cause 50% decrease in the binding of [3H]colchicine from purified porcine tubulin.


Bioorg Med Chem Lett 11: 51-4 (2001)


BindingDB Entry DOI: 10.7270/Q2C82CHT
More data for this
Ligand-Target Pair
Tubulin alpha-1A/beta chain


(Sus scrofa (Pig))
BDBM50095317
PNG
(2-Methoxy-5-(3,4,5-trimethoxy-phenoxymethyl)-pheno...)
Show SMILES COc1ccc(COc2cc(OC)c(OC)c(OC)c2)cc1O
Show InChI InChI=1S/C17H20O6/c1-19-14-6-5-11(7-13(14)18)10-23-12-8-15(20-2)17(22-4)16(9-12)21-3/h5-9,18H,10H2,1-4H3
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n/an/a 6.60E+3n/an/an/an/an/an/a



The University of Manchester

Curated by ChEMBL


Assay Description
Effect on tubulin binding and the concentration required to cause 50% decrease in tubulin assembly at 350 nm.


Bioorg Med Chem Lett 11: 51-4 (2001)


BindingDB Entry DOI: 10.7270/Q2C82CHT
More data for this
Ligand-Target Pair
Tubulin alpha-1A/beta chain


(Sus scrofa (Pig))
BDBM50135464
PNG
(CHEMBL3753885)
Show SMILES COc1cc(OC)cc(c1)-c1n[nH]nc1-c1c[nH]c2ccccc12
Show InChI InChI=1S/C18H16N4O2/c1-23-12-7-11(8-13(9-12)24-2)17-18(21-22-20-17)15-10-19-16-6-4-3-5-14(15)16/h3-10,19H,1-2H3,(H,20,21,22)
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n/an/a 1.35E+4n/an/an/an/an/an/a



University of Arkansas for Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of porcine brain tubulin polymerization by spectrophotometric analysis


Medchemcomm 6: 1535-1543 (2016)


BindingDB Entry DOI: 10.7270/Q2H41T8J
More data for this
Ligand-Target Pair
Tubulin alpha-1A/beta chain


(Sus scrofa (Pig))
BDBM50095326
PNG
(2-Methoxy-5-(3,4,5-trimethoxy-phenoxy)-phenol | CH...)
Show SMILES COc1ccc(Oc2cc(OC)c(OC)c(OC)c2)cc1O
Show InChI InChI=1S/C16H18O6/c1-18-13-6-5-10(7-12(13)17)22-11-8-14(19-2)16(21-4)15(9-11)20-3/h5-9,17H,1-4H3
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n/an/a 1.63E+4n/an/an/an/an/an/a



The University of Manchester

Curated by ChEMBL


Assay Description
Effect on tubulin binding and the concentration required to cause 50% decrease in tubulin assembly at 350 nm.


Bioorg Med Chem Lett 11: 51-4 (2001)


BindingDB Entry DOI: 10.7270/Q2C82CHT
More data for this
Ligand-Target Pair
Tubulin alpha-1A/beta chain


(Sus scrofa (Pig))
BDBM50135465
PNG
(CHEMBL3753880)
Show SMILES COc1cc(cc(OC)c1OC)-c1n[nH]nc1-c1c[nH]c2ccccc12
Show InChI InChI=1S/C19H18N4O3/c1-24-15-8-11(9-16(25-2)19(15)26-3)17-18(22-23-21-17)13-10-20-14-7-5-4-6-12(13)14/h4-10,20H,1-3H3,(H,21,22,23)
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n/an/a 1.85E+4n/an/an/an/an/an/a



University of Arkansas for Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of porcine brain tubulin polymerization by spectrophotometric analysis


Medchemcomm 6: 1535-1543 (2016)


BindingDB Entry DOI: 10.7270/Q2H41T8J
More data for this
Ligand-Target Pair
Tubulin alpha-1A/beta chain


(Sus scrofa (Pig))
BDBM50095320
PNG
(2-Methoxy-5-(3,4,5-trimethoxy-benzyloxy)-phenol | ...)
Show SMILES COc1ccc(OCc2cc(OC)c(OC)c(OC)c2)cc1O
Show InChI InChI=1S/C17H20O6/c1-19-14-6-5-12(9-13(14)18)23-10-11-7-15(20-2)17(22-4)16(8-11)21-3/h5-9,18H,10H2,1-4H3
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n/an/a 2.25E+4n/an/an/an/an/an/a



The University of Manchester

Curated by ChEMBL


Assay Description
Effect on tubulin binding and the concentration required to cause 50% decrease in tubulin assembly at 350 nm.


Bioorg Med Chem Lett 11: 51-4 (2001)


BindingDB Entry DOI: 10.7270/Q2C82CHT
More data for this
Ligand-Target Pair
Tubulin alpha-1A/beta chain


(Sus scrofa (Pig))
BDBM50095326
PNG
(2-Methoxy-5-(3,4,5-trimethoxy-phenoxy)-phenol | CH...)
Show SMILES COc1ccc(Oc2cc(OC)c(OC)c(OC)c2)cc1O
Show InChI InChI=1S/C16H18O6/c1-18-13-6-5-10(7-12(13)17)22-11-8-14(19-2)16(21-4)15(9-11)20-3/h5-9,17H,1-4H3
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n/an/a 3.60E+4n/an/an/an/an/an/a



The University of Manchester

Curated by ChEMBL


Assay Description
Concentration required to cause 50% decrease in the binding of [3H]colchicine from purified porcine tubulin.


Bioorg Med Chem Lett 11: 51-4 (2001)


BindingDB Entry DOI: 10.7270/Q2C82CHT
More data for this
Ligand-Target Pair
Tubulin alpha-1A/beta chain


(Sus scrofa (Pig))
BDBM50095317
PNG
(2-Methoxy-5-(3,4,5-trimethoxy-phenoxymethyl)-pheno...)
Show SMILES COc1ccc(COc2cc(OC)c(OC)c(OC)c2)cc1O
Show InChI InChI=1S/C17H20O6/c1-19-14-6-5-11(7-13(14)18)10-23-12-8-15(20-2)17(22-4)16(9-12)21-3/h5-9,18H,10H2,1-4H3
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n/an/a 3.60E+4n/an/an/an/an/an/a



The University of Manchester

Curated by ChEMBL


Assay Description
Concentration required to cause 50% decrease in the binding of [3H]colchicine from purified porcine tubulin.


Bioorg Med Chem Lett 11: 51-4 (2001)


BindingDB Entry DOI: 10.7270/Q2C82CHT
More data for this
Ligand-Target Pair
Tubulin alpha-1A/beta chain


(Sus scrofa (Pig))
BDBM50134459
PNG
(2-(3-Hydroxy-4-methoxy-phenyl)-6,7,8-trimethoxy-ch...)
Show SMILES COc1ccc(cc1O)-c1cc(=O)c2cc(OC)c(OC)c(OC)c2o1
Show InChI InChI=1S/C19H18O7/c1-22-14-6-5-10(7-13(14)21)15-9-12(20)11-8-16(23-2)18(24-3)19(25-4)17(11)26-15/h5-9,21H,1-4H3
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n/an/a 4.00E+4n/an/an/an/an/an/a



Cardiff University

Curated by ChEMBL


Assay Description
Ability to inhibit the binding of [3H]colchicine to porcine tubulin


Bioorg Med Chem Lett 13: 3759-63 (2003)


BindingDB Entry DOI: 10.7270/Q2G73D48
More data for this
Ligand-Target Pair
Tubulin alpha-1A/beta chain


(Sus scrofa (Pig))
BDBM50134450
PNG
(2-[1-(3-Hydroxy-4-methoxy-phenyl)-meth-(Z)-ylidene...)
Show SMILES COc1ccc(\C=C2/Oc3c(cc(OC)c(OC)c3OC)C2=O)cc1O
Show InChI InChI=1S/C19H18O7/c1-22-13-6-5-10(7-12(13)20)8-14-16(21)11-9-15(23-2)18(24-3)19(25-4)17(11)26-14/h5-9,20H,1-4H3/b14-8-
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n/an/a 6.00E+4n/an/an/an/an/an/a



Cardiff University

Curated by ChEMBL


Assay Description
Ability to inhibit the binding of [3H]colchicine to porcine tubulin


Bioorg Med Chem Lett 13: 3759-63 (2003)


BindingDB Entry DOI: 10.7270/Q2G73D48
More data for this
Ligand-Target Pair
Tubulin alpha-1A/beta chain


(Sus scrofa (Pig))
BDBM50095319
PNG
(2-Methoxy-5-(3,4,5-trimethoxy-phenylamino)-phenol ...)
Show SMILES COc1ccc(Nc2cc(OC)c(OC)c(OC)c2)cc1O
Show InChI InChI=1S/C16H19NO5/c1-19-13-6-5-10(7-12(13)18)17-11-8-14(20-2)16(22-4)15(9-11)21-3/h5-9,17-18H,1-4H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



The University of Manchester

Curated by ChEMBL


Assay Description
Effect on tubulin binding and the concentration required to cause 50% decrease in tubulin assembly at 350 nm.


Bioorg Med Chem Lett 11: 51-4 (2001)


BindingDB Entry DOI: 10.7270/Q2C82CHT
More data for this
Ligand-Target Pair
Tubulin alpha-1A/beta chain


(Sus scrofa (Pig))
BDBM50095320
PNG
(2-Methoxy-5-(3,4,5-trimethoxy-benzyloxy)-phenol | ...)
Show SMILES COc1ccc(OCc2cc(OC)c(OC)c(OC)c2)cc1O
Show InChI InChI=1S/C17H20O6/c1-19-14-6-5-12(9-13(14)18)23-10-11-7-15(20-2)17(22-4)16(8-11)21-3/h5-9,18H,10H2,1-4H3
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n/an/a 2.26E+5n/an/an/an/an/an/a



The University of Manchester

Curated by ChEMBL


Assay Description
Concentration required to cause 50% decrease in the binding of [3H]colchicine from purified porcine tubulin.


Bioorg Med Chem Lett 11: 51-4 (2001)


BindingDB Entry DOI: 10.7270/Q2C82CHT
More data for this
Ligand-Target Pair
Tubulin alpha-1A/beta chain


(Sus scrofa (Pig))
BDBM50095319
PNG
(2-Methoxy-5-(3,4,5-trimethoxy-phenylamino)-phenol ...)
Show SMILES COc1ccc(Nc2cc(OC)c(OC)c(OC)c2)cc1O
Show InChI InChI=1S/C16H19NO5/c1-19-13-6-5-10(7-12(13)18)17-11-8-14(20-2)16(22-4)15(9-11)21-3/h5-9,17-18H,1-4H3
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n/an/a 2.98E+5n/an/an/an/an/an/a



The University of Manchester

Curated by ChEMBL


Assay Description
Concentration required to cause 50% decrease in the binding of [3H]colchicine from purified porcine tubulin.


Bioorg Med Chem Lett 11: 51-4 (2001)


BindingDB Entry DOI: 10.7270/Q2C82CHT
More data for this
Ligand-Target Pair