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PubMed code 27031215

Compile data set for download or QSAR
Found 12 hits of Enzyme Inhibition Constant Data   
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
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50156464
PNG
(CHEMBL3793652)
Show SMILES COc1ccc(cc1O)-c1nnc2n(C)c(=O)c3ccccc3n12
Show InChI InChI=1S/C17H14N4O3/c1-20-16(23)11-5-3-4-6-12(11)21-15(18-19-17(20)21)10-7-8-14(24-2)13(22)9-10/h3-9,22H,1-2H3
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n/an/a 150n/an/an/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Inhibition of bovine tubulin polymerization after 1 hr by fluorescence spectrometry

Eur J Med Chem 115: 393-405 (2016)


Article DOI: 10.1016/j.ejmech.2016.03.056
BindingDB Entry DOI: 10.7270/Q2RN39RQ
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50156382
PNG
(CHEMBL3794202)
Show SMILES COc1ccc(cc1O)-c1nnc2[nH]c(=O)c3ccccc3n12
Show InChI InChI=1S/C16H12N4O3/c1-23-13-7-6-9(8-12(13)21)14-18-19-16-17-15(22)10-4-2-3-5-11(10)20(14)16/h2-8,21H,1H3,(H,17,19,22)
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n/an/a 4.26E+3n/an/an/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Inhibition of bovine tubulin polymerization after 1 hr by fluorescence spectrometry

Eur J Med Chem 115: 393-405 (2016)


Article DOI: 10.1016/j.ejmech.2016.03.056
BindingDB Entry DOI: 10.7270/Q2RN39RQ
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50156384
PNG
(CHEMBL3793564)
Show SMILES COc1cc(cc(OC)c1OC)-c1nnc2[nH]c(=O)c3ccccc3n12
Show InChI InChI=1S/C18H16N4O4/c1-24-13-8-10(9-14(25-2)15(13)26-3)16-20-21-18-19-17(23)11-6-4-5-7-12(11)22(16)18/h4-9H,1-3H3,(H,19,21,23)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Inhibition of bovine tubulin polymerization after 1 hr by fluorescence spectrometry

Eur J Med Chem 115: 393-405 (2016)


Article DOI: 10.1016/j.ejmech.2016.03.056
BindingDB Entry DOI: 10.7270/Q2RN39RQ
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50156462
PNG
(CHEMBL3793323)
Show SMILES Cn1c2nnc(-c3ccc(O)c(O)c3)n2c2ccccc2c1=O
Show InChI InChI=1S/C16H12N4O3/c1-19-15(23)10-4-2-3-5-11(10)20-14(17-18-16(19)20)9-6-7-12(21)13(22)8-9/h2-8,21-22H,1H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Inhibition of bovine tubulin polymerization after 1 hr by fluorescence spectrometry

Eur J Med Chem 115: 393-405 (2016)


Article DOI: 10.1016/j.ejmech.2016.03.056
BindingDB Entry DOI: 10.7270/Q2RN39RQ
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50156467
PNG
(CHEMBL3794178)
Show SMILES COc1ccc(cc1)-c1nnc2n(C)c(=O)c3ccccc3n12
Show InChI InChI=1S/C17H14N4O2/c1-20-16(22)13-5-3-4-6-14(13)21-15(18-19-17(20)21)11-7-9-12(23-2)10-8-11/h3-10H,1-2H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Inhibition of bovine tubulin polymerization after 1 hr by fluorescence spectrometry

Eur J Med Chem 115: 393-405 (2016)


Article DOI: 10.1016/j.ejmech.2016.03.056
BindingDB Entry DOI: 10.7270/Q2RN39RQ
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50156445
PNG
(CHEMBL3793547)
Show SMILES COc1ccc(cc1)-c1nnc2[nH]c(=O)c3ccccc3n12
Show InChI InChI=1S/C16H12N4O2/c1-22-11-8-6-10(7-9-11)14-18-19-16-17-15(21)12-4-2-3-5-13(12)20(14)16/h2-9H,1H3,(H,17,19,21)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Inhibition of bovine tubulin polymerization after 1 hr by fluorescence spectrometry

Eur J Med Chem 115: 393-405 (2016)


Article DOI: 10.1016/j.ejmech.2016.03.056
BindingDB Entry DOI: 10.7270/Q2RN39RQ
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50156465
PNG
(CHEMBL3793967)
Show SMILES COc1cc(cc(OC)c1OC)-c1nnc2n(C)c(=O)c3ccccc3n12
Show InChI InChI=1S/C19H18N4O4/c1-22-18(24)12-7-5-6-8-13(12)23-17(20-21-19(22)23)11-9-14(25-2)16(27-4)15(10-11)26-3/h5-10H,1-4H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Inhibition of bovine tubulin polymerization after 1 hr by fluorescence spectrometry

Eur J Med Chem 115: 393-405 (2016)


Article DOI: 10.1016/j.ejmech.2016.03.056
BindingDB Entry DOI: 10.7270/Q2RN39RQ
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50156381
PNG
(CHEMBL3794460)
Show SMILES COc1cc(ccc1O)-c1nnc2[nH]c(=O)c3ccccc3n12
Show InChI InChI=1S/C16H12N4O3/c1-23-13-8-9(6-7-12(13)21)14-18-19-16-17-15(22)10-4-2-3-5-11(10)20(14)16/h2-8,21H,1H3,(H,17,19,22)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Inhibition of bovine tubulin polymerization after 1 hr by fluorescence spectrometry

Eur J Med Chem 115: 393-405 (2016)


Article DOI: 10.1016/j.ejmech.2016.03.056
BindingDB Entry DOI: 10.7270/Q2RN39RQ
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50156447
PNG
(CHEMBL3792513)
Show SMILES COc1ccc(cc1N)-c1nnc2n(C)c(=O)c3ccccc3n12
Show InChI InChI=1S/C17H15N5O2/c1-21-16(23)11-5-3-4-6-13(11)22-15(19-20-17(21)22)10-7-8-14(24-2)12(18)9-10/h3-9H,18H2,1-2H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Inhibition of bovine tubulin polymerization after 1 hr by fluorescence spectrometry

Eur J Med Chem 115: 393-405 (2016)


Article DOI: 10.1016/j.ejmech.2016.03.056
BindingDB Entry DOI: 10.7270/Q2RN39RQ
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50156466
PNG
(CHEMBL3792479)
Show SMILES COc1ccc(cc1OC)-c1nnc2n(C)c(=O)c3ccccc3n12
Show InChI InChI=1S/C18H16N4O3/c1-21-17(23)12-6-4-5-7-13(12)22-16(19-20-18(21)22)11-8-9-14(24-2)15(10-11)25-3/h4-10H,1-3H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Inhibition of bovine tubulin polymerization after 1 hr by fluorescence spectrometry

Eur J Med Chem 115: 393-405 (2016)


Article DOI: 10.1016/j.ejmech.2016.03.056
BindingDB Entry DOI: 10.7270/Q2RN39RQ
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50156444
PNG
(CHEMBL3792547)
Show SMILES COc1ccc(cc1OC)-c1nnc2[nH]c(=O)c3ccccc3n12
Show InChI InChI=1S/C17H14N4O3/c1-23-13-8-7-10(9-14(13)24-2)15-19-20-17-18-16(22)11-5-3-4-6-12(11)21(15)17/h3-9H,1-2H3,(H,18,20,22)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Inhibition of bovine tubulin polymerization after 1 hr by fluorescence spectrometry

Eur J Med Chem 115: 393-405 (2016)


Article DOI: 10.1016/j.ejmech.2016.03.056
BindingDB Entry DOI: 10.7270/Q2RN39RQ
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50156463
PNG
(CHEMBL3793124)
Show SMILES COc1cc(ccc1O)-c1nnc2n(C)c(=O)c3ccccc3n12
Show InChI InChI=1S/C17H14N4O3/c1-20-16(23)11-5-3-4-6-12(11)21-15(18-19-17(20)21)10-7-8-13(22)14(9-10)24-2/h3-9,22H,1-2H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Inhibition of bovine tubulin polymerization after 1 hr by fluorescence spectrometry

Eur J Med Chem 115: 393-405 (2016)


Article DOI: 10.1016/j.ejmech.2016.03.056
BindingDB Entry DOI: 10.7270/Q2RN39RQ
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%