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PubMed code 1552500

Compile data set for download or QSAR
Found 28 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)		BDBM50009568
PNG
((Thiocolchicine)N-(1,2,3-Trimethoxy-10-methylsulfa...)
Show SMILES COc1cc2CC[C@H](NC(C)=O)c3cc(=O)c(SC)ccc3-c2c(OC)c1OC
Show InChI InChI=1S/C22H25NO5S/c1-12(24)23-16-8-6-13-10-18(26-2)21(27-3)22(28-4)20(13)14-7-9-19(29-5)17(25)11-15(14)16/h7,9-11,16H,6,8H2,1-5H3,(H,23,24)/t16-/m0/s1
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n/an/a 640n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of glutamate-dependent tubulin polymerization at 30 degrees C(0.25 mM MgCl2)

J Med Chem 35: 1058-67 (1992)


Article DOI: 10.1021/jm00084a011
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50005480
PNG
((-)-combretastatin | (Z)-3'-hydroxy-3,4,4',5-tetra...)
Show SMILES COc1ccc(\C=C/c2cc(OC)c(OC)c(OC)c2)cc1O
Show InChI InChI=1S/C18H20O5/c1-20-15-8-7-12(9-14(15)19)5-6-13-10-16(21-2)18(23-4)17(11-13)22-3/h5-11,19H,1-4H3/b6-5-
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n/an/a 1.10E+3n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of glutamate-dependent tubulin polymerization at 30 degrees C(0.25 mM MgCl2)

J Med Chem 35: 1058-67 (1992)


Article DOI: 10.1021/jm00084a011
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50230627
PNG
(CHEMBL10519)
Show SMILES COc1c(C=O)c(C=O)ccc1-c1ccc(OC)c(=O)cc1
Show InChI InChI=1S/C17H14O5/c1-21-16-8-5-11(4-7-15(16)20)13-6-3-12(9-18)14(10-19)17(13)22-2/h3-10H,1-2H3
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n/an/a 1.20E+3n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of glutamate-dependent tubulin polymerization at 30 degrees C(0.25 mM MgCl2)

J Med Chem 35: 1058-67 (1992)


Article DOI: 10.1021/jm00084a011
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50009568
PNG
((Thiocolchicine)N-(1,2,3-Trimethoxy-10-methylsulfa...)
Show SMILES COc1cc2CC[C@H](NC(C)=O)c3cc(=O)c(SC)ccc3-c2c(OC)c1OC
Show InChI InChI=1S/C22H25NO5S/c1-12(24)23-16-8-6-13-10-18(26-2)21(27-3)22(28-4)20(13)14-7-9-19(29-5)17(25)11-15(14)16/h7,9-11,16H,6,8H2,1-5H3,(H,23,24)/t16-/m0/s1
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n/an/a 1.40E+3n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Concentration required to inhibit the extent of glutamate-dependent tubulin polymerization by 50% at 37 degrees C(1.0 mM MgCl2)

J Med Chem 35: 1058-67 (1992)


Article DOI: 10.1021/jm00084a011
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50005478
PNG
(2-Methoxy-5-[2-(3,4,5-trimethoxy-phenyl)-ethyl]-ph...)
Show SMILES COc1ccc(CCc2cc(OC)c(OC)c(OC)c2)cc1O
Show InChI InChI=1S/C18H22O5/c1-20-15-8-7-12(9-14(15)19)5-6-13-10-16(21-2)18(23-4)17(11-13)22-3/h7-11,19H,5-6H2,1-4H3
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n/an/a 1.60E+3n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of glutamate-dependent tubulin polymerization at 30 degrees C(0.25 mM MgCl2)

J Med Chem 35: 1058-67 (1992)


Article DOI: 10.1021/jm00084a011
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50230630
PNG
(CHEMBL10144)
Show SMILES CCOc1cc2OCOc2cc1C(C)c1ccc(OC)cc1
Show InChI InChI=1S/C18H20O4/c1-4-20-16-10-18-17(21-11-22-18)9-15(16)12(2)13-5-7-14(19-3)8-6-13/h5-10,12H,4,11H2,1-3H3
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n/an/a 1.80E+3n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of glutamate-dependent tubulin polymerization at 30 degrees C(0.25 mM MgCl2)

J Med Chem 35: 1058-67 (1992)


Article DOI: 10.1021/jm00084a011
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50230635
PNG
(CHEMBL10642)
Show SMILES CCOc1cc2OCOc2cc1C\C=C\c1ccc(OC)cc1
Show InChI InChI=1S/C19H20O4/c1-3-21-17-12-19-18(22-13-23-19)11-15(17)6-4-5-14-7-9-16(20-2)10-8-14/h4-5,7-12H,3,6,13H2,1-2H3/b5-4+
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n/an/a 1.90E+3n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of glutamate-dependent tubulin polymerization at 30 degrees C(0.25 mM MgCl2)

J Med Chem 35: 1058-67 (1992)


Article DOI: 10.1021/jm00084a011
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50230622
PNG
(CHEMBL274212)
Show SMILES CCOc1cc2OCOc2cc1Cc1ccc(OC)cc1
Show InChI InChI=1S/C17H18O4/c1-3-19-15-10-17-16(20-11-21-17)9-13(15)8-12-4-6-14(18-2)7-5-12/h4-7,9-10H,3,8,11H2,1-2H3
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n/an/a 2.00E+3n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of glutamate-dependent tubulin polymerization at 30 degrees C(0.25 mM MgCl2)

J Med Chem 35: 1058-67 (1992)


Article DOI: 10.1021/jm00084a011
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50212289
PNG
(CHEMBL10121)
Show SMILES COc1ccc(Cc2cc(OC)c(OC)c(OC)c2)cc1O
Show InChI InChI=1S/C17H20O5/c1-19-14-6-5-11(8-13(14)18)7-12-9-15(20-2)17(22-4)16(10-12)21-3/h5-6,8-10,18H,7H2,1-4H3
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n/an/a 2.30E+3n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of glutamate-dependent tubulin polymerization at 30 degrees C(0.25 mM MgCl2)

J Med Chem 35: 1058-67 (1992)


Article DOI: 10.1021/jm00084a011
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50230626
PNG
(CHEMBL10703)
Show SMILES COc1ccc(cc1)C(C)c1cc2OCOc2cc1OC
Show InChI InChI=1S/C17H18O4/c1-11(12-4-6-13(18-2)7-5-12)14-8-16-17(21-10-20-16)9-15(14)19-3/h4-9,11H,10H2,1-3H3
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n/an/a 2.50E+3n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of glutamate-dependent tubulin polymerization at 30 degrees C(0.25 mM MgCl2)

J Med Chem 35: 1058-67 (1992)


Article DOI: 10.1021/jm00084a011
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50005480
PNG
((-)-combretastatin | (Z)-3'-hydroxy-3,4,4',5-tetra...)
Show SMILES COc1ccc(\C=C/c2cc(OC)c(OC)c(OC)c2)cc1O
Show InChI InChI=1S/C18H20O5/c1-20-15-8-7-12(9-14(15)19)5-6-13-10-16(21-2)18(23-4)17(11-13)22-3/h5-11,19H,1-4H3/b6-5-
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n/an/a 2.50E+3n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Concentration required to inhibit the extent of glutamate-dependent tubulin polymerization by 50% at 37 degrees C(1.0 mM MgCl2)

J Med Chem 35: 1058-67 (1992)


Article DOI: 10.1021/jm00084a011
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50230627
PNG
(CHEMBL10519)
Show SMILES COc1c(C=O)c(C=O)ccc1-c1ccc(OC)c(=O)cc1
Show InChI InChI=1S/C17H14O5/c1-21-16-8-5-11(4-7-15(16)20)13-6-3-12(9-18)14(10-19)17(13)22-2/h3-10H,1-2H3
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n/an/a 2.60E+3n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Concentration required to inhibit the extent of glutamate-dependent tubulin polymerization by 50% at 37 degrees C(1.0 mM MgCl2)

J Med Chem 35: 1058-67 (1992)


Article DOI: 10.1021/jm00084a011
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50230631
PNG
(CHEMBL275976)
Show SMILES CCOc1cc2OCOc2cc1CCCc1ccc(OC)cc1
Show InChI InChI=1S/C19H22O4/c1-3-21-17-12-19-18(22-13-23-19)11-15(17)6-4-5-14-7-9-16(20-2)10-8-14/h7-12H,3-6,13H2,1-2H3
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n/an/a 2.70E+3n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of glutamate-dependent tubulin polymerization at 30 degrees C(0.25 mM MgCl2)

J Med Chem 35: 1058-67 (1992)


Article DOI: 10.1021/jm00084a011
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50212303
PNG
(CHEMBL10215)
Show SMILES COc1ccc(CCCc2cc(OC)c(OC)c(OC)c2)cc1O
Show InChI InChI=1S/C19H24O5/c1-21-16-9-8-13(10-15(16)20)6-5-7-14-11-17(22-2)19(24-4)18(12-14)23-3/h8-12,20H,5-7H2,1-4H3
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n/an/a 3.00E+3n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of glutamate-dependent tubulin polymerization at 30 degrees C(0.25 mM MgCl2)

J Med Chem 35: 1058-67 (1992)


Article DOI: 10.1021/jm00084a011
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50005478
PNG
(2-Methoxy-5-[2-(3,4,5-trimethoxy-phenyl)-ethyl]-ph...)
Show SMILES COc1ccc(CCc2cc(OC)c(OC)c(OC)c2)cc1O
Show InChI InChI=1S/C18H22O5/c1-20-15-8-7-12(9-14(15)19)5-6-13-10-16(21-2)18(23-4)17(11-13)22-3/h7-11,19H,5-6H2,1-4H3
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n/an/a 3.50E+3n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Concentration required to inhibit the extent of glutamate-dependent tubulin polymerization by 50% at 37 degrees C(1.0 mM MgCl2)

J Med Chem 35: 1058-67 (1992)


Article DOI: 10.1021/jm00084a011
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50230625
PNG
(CHEMBL10686)
Show SMILES COc1ccc(CCCc2cc3OCOc3cc2OC)cc1
Show InChI InChI=1S/C18H20O4/c1-19-15-8-6-13(7-9-15)4-3-5-14-10-17-18(22-12-21-17)11-16(14)20-2/h6-11H,3-5,12H2,1-2H3
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n/an/a 3.80E+3n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of glutamate-dependent tubulin polymerization at 30 degrees C(0.25 mM MgCl2)

J Med Chem 35: 1058-67 (1992)


Article DOI: 10.1021/jm00084a011
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50230628
PNG
(CHEMBL273261)
Show SMILES CCOc1cc2OCOc2cc1CCc1ccc(OC)cc1
Show InChI InChI=1S/C18H20O4/c1-3-20-16-11-18-17(21-12-22-18)10-14(16)7-4-13-5-8-15(19-2)9-6-13/h5-6,8-11H,3-4,7,12H2,1-2H3
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n/an/a 3.80E+3n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of glutamate-dependent tubulin polymerization at 30 degrees C(0.25 mM MgCl2)

J Med Chem 35: 1058-67 (1992)


Article DOI: 10.1021/jm00084a011
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50230633
PNG
(CHEMBL10559)
Show SMILES COc1ccc(\C=C\Cc2cc3OCOc3cc2OC)cc1
Show InChI InChI=1S/C18H18O4/c1-19-15-8-6-13(7-9-15)4-3-5-14-10-17-18(22-12-21-17)11-16(14)20-2/h3-4,6-11H,5,12H2,1-2H3/b4-3+
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n/an/a 3.90E+3n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of glutamate-dependent tubulin polymerization at 30 degrees C(0.25 mM MgCl2)

J Med Chem 35: 1058-67 (1992)


Article DOI: 10.1021/jm00084a011
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50212300
PNG
(CHEMBL10127)
Show SMILES COc1ccc(CCCCc2cc(OC)c(OC)c(OC)c2)cc1O
Show InChI InChI=1S/C20H26O5/c1-22-17-10-9-14(11-16(17)21)7-5-6-8-15-12-18(23-2)20(25-4)19(13-15)24-3/h9-13,21H,5-8H2,1-4H3
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n/an/a 4.40E+3n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of glutamate-dependent tubulin polymerization at 30 degrees C(0.25 mM MgCl2)

J Med Chem 35: 1058-67 (1992)


Article DOI: 10.1021/jm00084a011
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50230629
PNG
(CHEMBL10405)
Show SMILES COc1ccc(Cc2cc3OCOc3cc2OC)cc1
Show InChI InChI=1S/C16H16O4/c1-17-13-5-3-11(4-6-13)7-12-8-15-16(20-10-19-15)9-14(12)18-2/h3-6,8-9H,7,10H2,1-2H3
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n/an/a 5.40E+3n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of glutamate-dependent tubulin polymerization at 30 degrees C(0.25 mM MgCl2)

J Med Chem 35: 1058-67 (1992)


Article DOI: 10.1021/jm00084a011
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50230632
PNG
(CHEMBL10185)
Show SMILES COc1ccc(CCCCc2cc3OCOc3cc2OC)cc1
Show InChI InChI=1S/C19H22O4/c1-20-16-9-7-14(8-10-16)5-3-4-6-15-11-18-19(23-13-22-18)12-17(15)21-2/h7-12H,3-6,13H2,1-2H3
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n/an/a 7.50E+3n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of glutamate-dependent tubulin polymerization at 30 degrees C(0.25 mM MgCl2)

J Med Chem 35: 1058-67 (1992)


Article DOI: 10.1021/jm00084a011
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50212289
PNG
(CHEMBL10121)
Show SMILES COc1ccc(Cc2cc(OC)c(OC)c(OC)c2)cc1O
Show InChI InChI=1S/C17H20O5/c1-19-14-6-5-11(8-13(14)18)7-12-9-15(20-2)17(22-4)16(10-12)21-3/h5-6,8-10,18H,7H2,1-4H3
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n/an/a 7.70E+3n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Concentration required to inhibit the extent of glutamate-dependent tubulin polymerization by 50% at 37 degrees C(1.0 mM MgCl2)

J Med Chem 35: 1058-67 (1992)


Article DOI: 10.1021/jm00084a011
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50230624
PNG
(CHEMBL269215)
Show SMILES COc1ccc(CCc2cc3OCOc3cc2OC)cc1
Show InChI InChI=1S/C17H18O4/c1-18-14-7-4-12(5-8-14)3-6-13-9-16-17(21-11-20-16)10-15(13)19-2/h4-5,7-10H,3,6,11H2,1-2H3
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n/an/a 8.80E+3n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of glutamate-dependent tubulin polymerization at 30 degrees C(0.25 mM MgCl2)

J Med Chem 35: 1058-67 (1992)


Article DOI: 10.1021/jm00084a011
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50212303
PNG
(CHEMBL10215)
Show SMILES COc1ccc(CCCc2cc(OC)c(OC)c(OC)c2)cc1O
Show InChI InChI=1S/C19H24O5/c1-21-16-9-8-13(10-15(16)20)6-5-7-14-11-17(22-2)19(24-4)18(12-14)23-3/h8-12,20H,5-7H2,1-4H3
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n/an/a 1.10E+4n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Concentration required to inhibit the extent of glutamate-dependent tubulin polymerization by 50% at 37 degrees C(1.0 mM MgCl2)

J Med Chem 35: 1058-67 (1992)


Article DOI: 10.1021/jm00084a011
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50212300
PNG
(CHEMBL10127)
Show SMILES COc1ccc(CCCCc2cc(OC)c(OC)c(OC)c2)cc1O
Show InChI InChI=1S/C20H26O5/c1-22-17-10-9-14(11-16(17)21)7-5-6-8-15-12-18(23-2)20(25-4)19(13-15)24-3/h9-13,21H,5-8H2,1-4H3
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n/an/a 3.00E+4n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Concentration required to inhibit the extent of glutamate-dependent tubulin polymerization by 50% at 37 degrees C(1.0 mM MgCl2)

J Med Chem 35: 1058-67 (1992)


Article DOI: 10.1021/jm00084a011
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50230634
PNG
(CHEMBL10653)
Show SMILES CCOc1cc2OCOc2cc1\C=C/c1ccc(OC)cc1
Show InChI InChI=1S/C18H18O4/c1-3-20-16-11-18-17(21-12-22-18)10-14(16)7-4-13-5-8-15(19-2)9-6-13/h4-11H,3,12H2,1-2H3/b7-4-
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UniChem

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n/an/a>4.00E+4n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of glutamate-dependent tubulin polymerization at 30 degrees C(0.25 mM MgCl2)

J Med Chem 35: 1058-67 (1992)


Article DOI: 10.1021/jm00084a011
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50230623
PNG
(CHEMBL10255)
Show SMILES COc1ccc(cc1O)-c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C16H18O5/c1-18-13-6-5-10(7-12(13)17)11-8-14(19-2)16(21-4)15(9-11)20-3/h5-9,17H,1-4H3
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UniChem

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n/an/a>4.00E+4n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Inhibition of glutamate-dependent tubulin polymerization at 30 degrees C(0.25 mM MgCl2)

J Med Chem 35: 1058-67 (1992)


Article DOI: 10.1021/jm00084a011
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50230623
PNG
(CHEMBL10255)
Show SMILES COc1ccc(cc1O)-c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C16H18O5/c1-18-13-6-5-10(7-12(13)17)11-8-14(19-2)16(21-4)15(9-11)20-3/h5-9,17H,1-4H3
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UniChem

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n/an/a>4.00E+4n/an/an/an/an/an/a



National Cancer Institute

Curated by ChEMBL


Assay Description
Concentration required to inhibit the extent of glutamate-dependent tubulin polymerization by 50% at 37 degrees C(1.0 mM MgCl2)

J Med Chem 35: 1058-67 (1992)


Article DOI: 10.1021/jm00084a011
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%