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Compile Data Set for Download or QSAR

Found 53 hits of ic50 for UniProtKB: P02554   
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 beta chain


(Sus scrofa)
BDBM50012278
PNG
((2ALPHA,2''BETA,3BETA,4ALPHA,5BETA)-VINCALEUKOBLAS...)
Show SMILES CC[C@]1(O)C[C@@H]2CN(C1)CCc1c([nH]c3ccccc13)[C@@](C2)(C(=O)OC)c1cc2c(cc1OC)N(C)[C@@H]1[C@]22CCN3CC=C[C@](CC)([C@@H]23)[C@@H](OC(C)=O)[C@]1(O)C(=O)OC
Show InChI InChI=1S/C46H58N4O9/c1-8-42(54)23-28-24-45(40(52)57-6,36-30(15-19-49(25-28)26-42)29-13-10-11-14-33(29)47-36)32-21-31-34(22-35(32)56-5)48(4)38-44(31)17-20-50-18-12-16-43(9-2,37(44)50)39(59-27(3)51)46(38,55)41(53)58-7/h10-14,16,21-22,28,37-39,47,54-55H,8-9,15,17-20,23-26H2,1-7H3/t28-,37-,38+,39+,42-,43+,44+,45-,46-/m0/s1
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n/an/a 1.10n/an/an/an/an/an/a



Ghent University

Curated by ChEMBL


Assay Description
Inhibition of porcine brain tubulin polymerization assessed as microtubule assembly after 15 mins by DAPI staining


Eur J Med Chem 101: 627-39 (2015)


Article DOI: 10.1016/j.ejmech.2015.06.029
BindingDB Entry DOI: 10.7270/Q2QF8VPZ
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Tubulin beta chain


(Sus scrofa)
BDBM50012278
PNG
((2ALPHA,2''BETA,3BETA,4ALPHA,5BETA)-VINCALEUKOBLAS...)
Show SMILES CC[C@]1(O)C[C@@H]2CN(C1)CCc1c([nH]c3ccccc13)[C@@](C2)(C(=O)OC)c1cc2c(cc1OC)N(C)[C@@H]1[C@]22CCN3CC=C[C@](CC)([C@@H]23)[C@@H](OC(C)=O)[C@]1(O)C(=O)OC
Show InChI InChI=1S/C46H58N4O9/c1-8-42(54)23-28-24-45(40(52)57-6,36-30(15-19-49(25-28)26-42)29-13-10-11-14-33(29)47-36)32-21-31-34(22-35(32)56-5)48(4)38-44(31)17-20-50-18-12-16-43(9-2,37(44)50)39(59-27(3)51)46(38,55)41(53)58-7/h10-14,16,21-22,28,37-39,47,54-55H,8-9,15,17-20,23-26H2,1-7H3/t28-,37-,38+,39+,42-,43+,44+,45-,46-/m0/s1
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n/an/a 600n/an/an/an/an/an/a



Medicinal Chemistry Research Laboratory, Daiichi Pharmaceutical Co. Ltd., 16-13, Kita-kasai 1-chome, Edogawa-ku, 134, Tokyo, Japan. okihi10g@daiichipharm.co.jp

Curated by ChEMBL


Assay Description
Concentration of compound required to inhibit tubulin polymerization (Microtubule assembly) was determined by the turbidity formation after 20 min of...


Bioorg Med Chem Lett 12: 3191-3 (2002)


Article DOI: 10.1016/s0960-894x(02)00568-1
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Tubulin


(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



Department of Chemistry, UMIST, Manchester, UK. lawrencenj1@cardiff.ac.uk

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)


Article DOI: 10.1016/s0960-894x(00)00596-5
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
BDBM50154910
PNG
(CHEMBL3775353)
Show SMILES COc1ccc(cc1\C=C1\C(=O)Nc2ccc(F)cc12)C(=O)c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C26H22FNO6/c1-31-21-8-5-14(24(29)16-11-22(32-2)25(34-4)23(12-16)33-3)9-15(21)10-19-18-13-17(27)6-7-20(18)28-26(19)30/h5-13H,1-4H3,(H,28,30)/b19-10+
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n/an/a 1.01E+3n/an/an/an/an/an/a



CSIR-Indian Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibition of porcine brain tubulin polymerization after 1 hr by fluorescence assay


Bioorg Med Chem 24: 1729-40 (2016)


Article DOI: 10.1016/j.bmc.2016.02.047
BindingDB Entry DOI: 10.7270/Q22809G0
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
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 1.06E+3n/an/an/an/an/an/a



CSIR-Indian Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibition of porcine brain tubulin polymerization after 1 hr by fluorescence assay


Bioorg Med Chem 24: 1729-40 (2016)


Article DOI: 10.1016/j.bmc.2016.02.047
BindingDB Entry DOI: 10.7270/Q22809G0
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
BDBM50030766
PNG
(CHEMBL3342339)
Show SMILES O=C(c1ccccc1)c1cccc(\C=c2/[nH]c(=O)\c(=C\c3ccccn3)[nH]c2=O)c1
Show InChI InChI=1S/C24H17N3O3/c28-22(17-8-2-1-3-9-17)18-10-6-7-16(13-18)14-20-23(29)27-21(24(30)26-20)15-19-11-4-5-12-25-19/h1-15H,(H,26,30)(H,27,29)/b20-14-,21-15-
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n/an/a 1.20E+3n/an/an/an/an/an/a



Tokyo University of Pharmacy and Life Sciences

Curated by ChEMBL


Assay Description
Inhibition of porcine tubulin polymerization by spectrophotometry


ACS Med Chem Lett 5: 1094-8 (2014)


Article DOI: 10.1021/ml5001883
BindingDB Entry DOI: 10.7270/Q2R49SCP
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
BDBM50154909
PNG
(CHEMBL3775082)
Show SMILES COc1ccc2NC(=O)\C(=C\c3cc(ccc3OC)C(=O)c3cc(OC)c(OC)c(OC)c3)c2c1
Show InChI InChI=1S/C27H25NO7/c1-31-18-7-8-21-19(14-18)20(27(30)28-21)11-16-10-15(6-9-22(16)32-2)25(29)17-12-23(33-3)26(35-5)24(13-17)34-4/h6-14H,1-5H3,(H,28,30)/b20-11+
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n/an/a 1.23E+3n/an/an/an/an/an/a



CSIR-Indian Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibition of porcine brain tubulin polymerization after 1 hr by fluorescence assay


Bioorg Med Chem 24: 1729-40 (2016)


Article DOI: 10.1016/j.bmc.2016.02.047
BindingDB Entry DOI: 10.7270/Q22809G0
More data for this
Ligand-Target Pair
Tubulin


(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)


Article DOI: 10.1039/c5md00219b
BindingDB Entry DOI: 10.7270/Q2H41T8J
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
BDBM50030765
PNG
(NPI-2358 | PLINABULIN | Plinabulin)
Show SMILES CC(C)(C)c1[nH]cnc1\C=c1/[nH]c(=O)\c(=C\c2ccccc2)[nH]c1=O
Show InChI InChI=1S/C19H20N4O2/c1-19(2,3)16-13(20-11-21-16)10-15-18(25)22-14(17(24)23-15)9-12-7-5-4-6-8-12/h4-11H,1-3H3,(H,20,21)(H,22,25)(H,23,24)/b14-9-,15-10-
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n/an/a 1.80E+3n/an/an/an/an/an/a



Tokyo University of Pharmacy and Life Sciences

Curated by ChEMBL


Assay Description
Inhibition of porcine tubulin polymerization by spectrophotometry


ACS Med Chem Lett 5: 1094-8 (2014)


Article DOI: 10.1021/ml5001883
BindingDB Entry DOI: 10.7270/Q2R49SCP
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Tubulin beta chain


(Sus scrofa)
BDBM50056777
PNG
(CHEMBL3331358)
Show SMILES COc1cc2[C@H]3CC[C@@]4(C)[C@@H](CC[C@@H]4c4ccc5cnccc5c4)[C@@H]3CCc2cc1O
Show InChI InChI=1S/C28H31NO2/c1-28-11-9-21-22(6-5-18-14-26(30)27(31-2)15-23(18)21)25(28)8-7-24(28)19-3-4-20-16-29-12-10-17(20)13-19/h3-4,10,12-16,21-22,24-25,30H,5-9,11H2,1-2H3/t21-,22+,24+,25-,28+/m0/s1
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n/an/a 2.10E+3n/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Inhibition of porcine brain tubulin polymerization after 60 mins


Eur J Med Chem 85: 391-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.002
BindingDB Entry DOI: 10.7270/Q21V5GM9
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
BDBM50056783
PNG
(CHEMBL3331351)
Show SMILES COc1cc2[C@H]3CC[C@@]4(C)[C@@H](CC=C4c4ccc5cnccc5c4)[C@@H]3CCc2cc1O
Show InChI InChI=1S/C28H29NO2/c1-28-11-9-21-22(6-5-18-14-26(30)27(31-2)15-23(18)21)25(28)8-7-24(28)19-3-4-20-16-29-12-10-17(20)13-19/h3-4,7,10,12-16,21-22,25,30H,5-6,8-9,11H2,1-2H3/t21-,22+,25-,28+/m0/s1
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n/an/a 2.20E+3n/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Inhibition of porcine brain tubulin polymerization after 60 mins


Eur J Med Chem 85: 391-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.002
BindingDB Entry DOI: 10.7270/Q21V5GM9
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
BDBM50060957
PNG
(2-Hydroxyestradol 2-methyl ether | 2-methoxy-17bet...)
Show SMILES COc1cc2[C@H]3CC[C@]4(C)[C@@H](O)CC[C@H]4[C@@H]3CCc2cc1O
Show InChI InChI=1S/C19H26O3/c1-19-8-7-12-13(15(19)5-6-18(19)21)4-3-11-9-16(20)17(22-2)10-14(11)12/h9-10,12-13,15,18,20-21H,3-8H2,1-2H3/t12-,13+,15-,18-,19-/m0/s1
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n/an/a 2.20E+3n/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Inhibition of porcine brain tubulin polymerization after 60 mins


Eur J Med Chem 85: 391-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.002
BindingDB Entry DOI: 10.7270/Q21V5GM9
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
BDBM50056779
PNG
(CHEMBL3331356)
Show SMILES COc1cc2[C@H]3CC[C@@]4(C)[C@@H](CC[C@@H]4c4cncc5CCCCc45)[C@@H]3CCc2cc1O
Show InChI InChI=1S/C28H35NO2/c1-28-12-11-20-21(8-7-17-13-26(30)27(31-2)14-22(17)20)24(28)9-10-25(28)23-16-29-15-18-5-3-4-6-19(18)23/h13-16,20-21,24-25,30H,3-12H2,1-2H3/t20-,21+,24-,25+,28-/m0/s1
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n/an/a 2.50E+3n/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Inhibition of porcine brain tubulin polymerization after 60 mins


Eur J Med Chem 85: 391-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.002
BindingDB Entry DOI: 10.7270/Q21V5GM9
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
BDBM50181051
PNG
(CHEMBL3818850)
Show SMILES COc1ccc2c(\C=C(/C)C(=O)c3cc(OC)c(OC)c(OC)c3)c[nH]c2c1
Show InChI InChI=1S/C22H23NO5/c1-13(8-15-12-23-18-11-16(25-2)6-7-17(15)18)21(24)14-9-19(26-3)22(28-5)20(10-14)27-4/h6-12,23H,1-5H3/b13-8+
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n/an/a 2.68E+3n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of porcine brain tubulin polymerization measured every 60 secs for 90 mins by DAPI staining-based fluorescence assay


J Med Chem 59: 5264-83 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00021
BindingDB Entry DOI: 10.7270/Q2H41TBF
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
BDBM50056782
PNG
(CHEMBL3331353)
Show SMILES COc1cc2[C@H]3CC[C@@]4(C)[C@@H](CC=C4c4cccc5ncccc45)[C@@H]3CCc2cc1O
Show InChI InChI=1S/C28H29NO2/c1-28-13-12-18-20(9-8-17-15-26(30)27(31-2)16-22(17)18)24(28)11-10-23(28)19-5-3-7-25-21(19)6-4-14-29-25/h3-7,10,14-16,18,20,24,30H,8-9,11-13H2,1-2H3/t18-,20+,24-,28+/m0/s1
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n/an/a 3.10E+3n/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Inhibition of porcine brain tubulin polymerization after 60 mins


Eur J Med Chem 85: 391-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.002
BindingDB Entry DOI: 10.7270/Q21V5GM9
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
BDBM50152675
PNG
(CHEMBL3780099)
Show SMILES COc1ccc(CNc2c(nc3ccc(F)cn23)-c2ccccc2O)cc1
Show InChI InChI=1S/C21H18FN3O2/c1-27-16-9-6-14(7-10-16)12-23-21-20(17-4-2-3-5-18(17)26)24-19-11-8-15(22)13-25(19)21/h2-11,13,23,26H,12H2,1H3
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n/an/a 3.41E+3n/an/an/an/an/an/a



Shanghai Institute of Materia Medica

Curated by ChEMBL


Assay Description
Inhibition of porcine tubulin polymerization by UV-Vis microplate reader analysis


Eur J Med Chem 112: 367-72 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.004
BindingDB Entry DOI: 10.7270/Q2ZK5JHD
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
BDBM50181050
PNG
(CHEMBL3819590)
Show SMILES COc1ccc2c(\C=C\C(=O)c3cc(OC)c(OC)c(OC)c3)cn(C)c2c1
Show InChI InChI=1S/C22H23NO5/c1-23-13-14(17-8-7-16(25-2)12-18(17)23)6-9-19(24)15-10-20(26-3)22(28-5)21(11-15)27-4/h6-13H,1-5H3/b9-6+
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n/an/a 3.48E+3n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of porcine brain tubulin polymerization measured every 60 secs for 90 mins by DAPI staining-based fluorescence assay


J Med Chem 59: 5264-83 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00021
BindingDB Entry DOI: 10.7270/Q2H41TBF
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
BDBM50181053
PNG
(CHEMBL3819240)
Show SMILES COc1ccc2c(\C=C(/C)C(=O)c3cc(OC)c(OC)c(OC)c3)cn(CO)c2c1
Show InChI InChI=1S/C23H25NO6/c1-14(22(26)15-9-20(28-3)23(30-5)21(10-15)29-4)8-16-12-24(13-25)19-11-17(27-2)6-7-18(16)19/h6-12,25H,13H2,1-5H3/b14-8+
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n/an/a 3.59E+3n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of porcine brain tubulin polymerization measured every 60 secs for 90 mins by DAPI staining-based fluorescence assay


J Med Chem 59: 5264-83 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00021
BindingDB Entry DOI: 10.7270/Q2H41TBF
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
BDBM50056775
PNG
(CHEMBL3331360)
Show SMILES COc1cc2[C@H]3CC[C@@]4(C)[C@@H](CC[C@@H]4c4cccc5NCCCc45)[C@@H]3CCc2cc1O
Show InChI InChI=1S/C28H35NO2/c1-28-13-12-18-20(9-8-17-15-26(30)27(31-2)16-22(17)18)24(28)11-10-23(28)19-5-3-7-25-21(19)6-4-14-29-25/h3,5,7,15-16,18,20,23-24,29-30H,4,6,8-14H2,1-2H3/t18-,20+,23+,24-,28+/m0/s1
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n/an/a 3.70E+3n/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Inhibition of porcine brain tubulin polymerization after 60 mins


Eur J Med Chem 85: 391-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.002
BindingDB Entry DOI: 10.7270/Q21V5GM9
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
BDBM50217543
PNG
(CHEMBL540565)
Show SMILES Cl.Cc1c(\C=C\CN2CCN(CC2)c2cc(F)cc(F)c2)cnn1-c1ccnc(N)n1
Show InChI InChI=1S/C21H23F2N7.ClH/c1-15-16(14-26-30(15)20-4-5-25-21(24)27-20)3-2-6-28-7-9-29(10-8-28)19-12-17(22)11-18(23)13-19;/h2-5,11-14H,6-10H2,1H3,(H2,24,25,27);1H/b3-2+;
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n/an/a 3.72E+3n/an/an/an/an/an/a



Medicinal Chemistry Research Laboratory, Daiichi Pharmaceutical Co. Ltd., 16-13, Kita-kasai 1-chome, Edogawa-ku, 134, Tokyo, Japan. okihi10g@daiichipharm.co.jp

Curated by ChEMBL


Assay Description
Concentration of compound required to inhibit tubulin polymerization (Microtubule assembly) was determined by the turbidity formation after 20 min of...


Bioorg Med Chem Lett 12: 3191-3 (2002)


Article DOI: 10.1016/s0960-894x(02)00568-1
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
BDBM50014846
PNG
((S)-N-(5,6,7,9-tetrahydro-1,2,3,10-tetramethoxy-9-...)
Show SMILES COc1cc2CC[C@H](NC(C)=O)c3cc(=O)c(OC)ccc3-c2c(OC)c1OC
Show InChI InChI=1S/C22H25NO6/c1-12(24)23-16-8-6-13-10-19(27-3)21(28-4)22(29-5)20(13)14-7-9-18(26-2)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 3.79E+3n/an/an/an/an/an/a



Shanghai Institute of Materia Medica

Curated by ChEMBL


Assay Description
Inhibition of porcine tubulin polymerization by UV-Vis microplate reader analysis


Eur J Med Chem 112: 367-72 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.004
BindingDB Entry DOI: 10.7270/Q2ZK5JHD
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Tubulin beta chain


(Sus scrofa)
BDBM50216141
PNG
(CHEMBL61572)
Show SMILES COc1ccc(cc1O)[C@@H]1OCO[C@H]1c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C19H22O7/c1-21-14-6-5-11(7-13(14)20)17-18(26-10-25-17)12-8-15(22-2)19(24-4)16(9-12)23-3/h5-9,17-18,20H,10H2,1-4H3/t17-,18-/m0/s1
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n/an/a 4.00E+3n/an/an/an/an/an/a



Institute of Molecular and Cellular Biosciences (IMCB), University of Tokyo, Japan.

Curated by ChEMBL


Assay Description
In vitro tubulin polymerization-inhibitory activity; 4-6


Bioorg Med Chem Lett 8: 1997-2000 (1998)


Article DOI: 10.1016/s0960-894x(98)00344-8
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
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 4.00E+3n/an/an/an/an/an/a



Institute of Molecular and Cellular Biosciences (IMCB), University of Tokyo, Japan.

Curated by ChEMBL


Assay Description
In vitro tubulin polymerization-inhibitory activity.


Bioorg Med Chem Lett 8: 1997-2000 (1998)


Article DOI: 10.1016/s0960-894x(98)00344-8
More data for this
Ligand-Target Pair
Tubulin


(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



Department of Chemistry, UMIST, Manchester, UK. lawrencenj1@cardiff.ac.uk

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)


Article DOI: 10.1016/s0960-894x(00)00596-5
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
BDBM50056798
PNG
(CHEMBL3331347)
Show SMILES COc1cc2[C@H]3CC[C@@]4(C)[C@@H](CC=C4c4ccncc4)[C@@H]3CCc2cc1O
Show InChI InChI=1S/C24H27NO2/c1-24-10-7-17-18(4-3-16-13-22(26)23(27-2)14-19(16)17)21(24)6-5-20(24)15-8-11-25-12-9-15/h5,8-9,11-14,17-18,21,26H,3-4,6-7,10H2,1-2H3/t17-,18+,21-,24+/m0/s1
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n/an/a 4.10E+3n/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Inhibition of porcine brain tubulin polymerization after 60 mins


Eur J Med Chem 85: 391-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.002
BindingDB Entry DOI: 10.7270/Q21V5GM9
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
BDBM50152676
PNG
(CHEMBL3780828)
Show SMILES COc1ccc(CNc2c(nc3ccccn23)-c2ccccc2O)cc1
Show InChI InChI=1S/C21H19N3O2/c1-26-16-11-9-15(10-12-16)14-22-21-20(17-6-2-3-7-18(17)25)23-19-8-4-5-13-24(19)21/h2-13,22,25H,14H2,1H3
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n/an/a 4.35E+3n/an/an/an/an/an/a



Shanghai Institute of Materia Medica

Curated by ChEMBL


Assay Description
Inhibition of porcine tubulin polymerization by UV-Vis microplate reader analysis


Eur J Med Chem 112: 367-72 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.004
BindingDB Entry DOI: 10.7270/Q2ZK5JHD
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
BDBM50181052
PNG
(CHEMBL3819618)
Show SMILES COc1ccc2c(\C=C\C(=O)c3ccc(OC)c4C=CC(C)(C)Oc34)c[nH]c2c1
Show InChI InChI=1S/C24H23NO4/c1-24(2)12-11-19-22(28-4)10-8-18(23(19)29-24)21(26)9-5-15-14-25-20-13-16(27-3)6-7-17(15)20/h5-14,25H,1-4H3/b9-5+
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n/an/a 4.39E+3n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of porcine brain tubulin polymerization measured every 60 secs for 90 mins by DAPI staining-based fluorescence assay


J Med Chem 59: 5264-83 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00021
BindingDB Entry DOI: 10.7270/Q2H41TBF
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
BDBM50056794
PNG
(CHEMBL3331349)
Show SMILES COc1cc2[C@H]3CC[C@@]4(C)[C@@H](CC=C4c4cncc5ccccc45)[C@@H]3CCc2cc1O
Show InChI InChI=1S/C28H29NO2/c1-28-12-11-20-21(8-7-17-13-26(30)27(31-2)14-22(17)20)24(28)9-10-25(28)23-16-29-15-18-5-3-4-6-19(18)23/h3-6,10,13-16,20-21,24,30H,7-9,11-12H2,1-2H3/t20-,21+,24-,28-/m0/s1
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n/an/a 4.80E+3n/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Inhibition of porcine brain tubulin polymerization after 60 mins


Eur J Med Chem 85: 391-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.002
BindingDB Entry DOI: 10.7270/Q21V5GM9
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
BDBM50181049
PNG
(CHEMBL3818763)
Show SMILES COc1ccc2[nH]cc(\C=C(/C)C(=O)c3cc(OC)c(OC)c(OC)c3)c2c1
Show InChI InChI=1S/C22H23NO5/c1-13(8-15-12-23-18-7-6-16(25-2)11-17(15)18)21(24)14-9-19(26-3)22(28-5)20(10-14)27-4/h6-12,23H,1-5H3/b13-8+
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n/an/a 5.06E+3n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of porcine brain tubulin polymerization measured every 60 secs for 90 mins by DAPI staining-based fluorescence assay


J Med Chem 59: 5264-83 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00021
BindingDB Entry DOI: 10.7270/Q2H41TBF
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
BDBM50056781
PNG
(CHEMBL3331354)
Show SMILES COc1cc2[C@H]3CC[C@@]4(C)[C@@H](CC[C@@H]4c4cccnc4)[C@@H]3CCc2cc1O
Show InChI InChI=1S/C24H29NO2/c1-24-10-9-17-18(6-5-15-12-22(26)23(27-2)13-19(15)17)21(24)8-7-20(24)16-4-3-11-25-14-16/h3-4,11-14,17-18,20-21,26H,5-10H2,1-2H3/t17-,18+,20+,21-,24+/m0/s1
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n/an/a 5.10E+3n/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Inhibition of porcine brain tubulin polymerization after 60 mins


Eur J Med Chem 85: 391-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.002
BindingDB Entry DOI: 10.7270/Q21V5GM9
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
BDBM50056780
PNG
(CHEMBL3331355)
Show SMILES COc1cc2[C@H]3CC[C@@]4(C)[C@@H](CC[C@@H]4c4ccncc4)[C@@H]3CCc2cc1O
Show InChI InChI=1S/C24H29NO2/c1-24-10-7-17-18(4-3-16-13-22(26)23(27-2)14-19(16)17)21(24)6-5-20(24)15-8-11-25-12-9-15/h8-9,11-14,17-18,20-21,26H,3-7,10H2,1-2H3/t17-,18+,20+,21-,24+/m0/s1
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n/an/a 5.80E+3n/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Inhibition of porcine brain tubulin polymerization after 60 mins


Eur J Med Chem 85: 391-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.002
BindingDB Entry DOI: 10.7270/Q21V5GM9
More data for this
Ligand-Target Pair
Tubulin


(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



Department of Chemistry, UMIST, Manchester, UK. lawrencenj1@cardiff.ac.uk

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)


Article DOI: 10.1016/s0960-894x(00)00596-5
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
BDBM50152677
PNG
(CHEMBL3780715)
Show SMILES COc1ccc(CNc2c(nc3cnccn23)-c2ccccc2O)cc1
Show InChI InChI=1S/C20H18N4O2/c1-26-15-8-6-14(7-9-15)12-22-20-19(16-4-2-3-5-17(16)25)23-18-13-21-10-11-24(18)20/h2-11,13,22,25H,12H2,1H3
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n/an/a 7.16E+3n/an/an/an/an/an/a



Shanghai Institute of Materia Medica

Curated by ChEMBL


Assay Description
Inhibition of porcine tubulin polymerization by UV-Vis microplate reader analysis


Eur J Med Chem 112: 367-72 (2016)


Article DOI: 10.1016/j.ejmech.2016.02.004
BindingDB Entry DOI: 10.7270/Q2ZK5JHD
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
BDBM50056791
PNG
(CHEMBL3331350)
Show SMILES COc1cc2[C@H]3CC[C@@]4(C)[C@@H](CC=C4c4cccc5cnccc45)[C@@H]3CCc2cc1O
Show InChI InChI=1S/C28H29NO2/c1-28-12-10-20-22(7-6-17-14-26(30)27(31-2)15-23(17)20)25(28)9-8-24(28)21-5-3-4-18-16-29-13-11-19(18)21/h3-5,8,11,13-16,20,22,25,30H,6-7,9-10,12H2,1-2H3/t20-,22+,25-,28+/m0/s1
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n/an/a 7.20E+3n/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Inhibition of porcine brain tubulin polymerization after 60 mins


Eur J Med Chem 85: 391-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.002
BindingDB Entry DOI: 10.7270/Q21V5GM9
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
BDBM50056778
PNG
(CHEMBL3331357)
Show SMILES COc1cc2[C@H]3CC[C@@]4(C)[C@@H](CC[C@@H]4c4cccc5cnccc45)[C@@H]3CCc2cc1O
Show InChI InChI=1S/C28H31NO2/c1-28-12-10-20-22(7-6-17-14-26(30)27(31-2)15-23(17)20)25(28)9-8-24(28)21-5-3-4-18-16-29-13-11-19(18)21/h3-5,11,13-16,20,22,24-25,30H,6-10,12H2,1-2H3/t20-,22+,24+,25-,28+/m0/s1
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n/an/a 8.10E+3n/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Inhibition of porcine brain tubulin polymerization after 60 mins


Eur J Med Chem 85: 391-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.002
BindingDB Entry DOI: 10.7270/Q21V5GM9
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
BDBM50217597
PNG
(CHEMBL542447)
Show SMILES Cl.Cc1c(\C=C\CN2CCN(CC2)c2cc(F)cc(F)c2)cnn1-c1ncccn1
Show InChI InChI=1S/C21H22F2N6.ClH/c1-16-17(15-26-29(16)21-24-5-3-6-25-21)4-2-7-27-8-10-28(11-9-27)20-13-18(22)12-19(23)14-20;/h2-6,12-15H,7-11H2,1H3;1H/b4-2+;
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n/an/a 9.08E+3n/an/an/an/an/an/a



Medicinal Chemistry Research Laboratory, Daiichi Pharmaceutical Co. Ltd., 16-13, Kita-kasai 1-chome, Edogawa-ku, 134, Tokyo, Japan. okihi10g@daiichipharm.co.jp

Curated by ChEMBL


Assay Description
Concentration of compound required to inhibit tubulin polymerization (Microtubule assembly) was determined by the turbidity formation after 20 min of...


Bioorg Med Chem Lett 12: 3191-3 (2002)


Article DOI: 10.1016/s0960-894x(02)00568-1
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
BDBM50014846
PNG
((S)-N-(5,6,7,9-tetrahydro-1,2,3,10-tetramethoxy-9-...)
Show SMILES COc1cc2CC[C@H](NC(C)=O)c3cc(=O)c(OC)ccc3-c2c(OC)c1OC
Show InChI InChI=1S/C22H25NO6/c1-12(24)23-16-8-6-13-10-19(27-3)21(28-4)22(29-5)20(13)14-7-9-18(26-2)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 1.00E+4n/an/an/an/an/an/a



Institute of Molecular and Cellular Biosciences (IMCB), University of Tokyo, Japan.

Curated by ChEMBL


Assay Description
In vitro tubulin polymerization-inhibitory activity.


Bioorg Med Chem Lett 8: 1997-2000 (1998)


Article DOI: 10.1016/s0960-894x(98)00344-8
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Tubulin beta chain


(Sus scrofa)
BDBM50056776
PNG
(CHEMBL3331359)
Show SMILES COc1cc2[C@H]3CC[C@@]4(C)[C@@H](CC[C@@H]4c4ccc5ccncc5c4)[C@@H]3CCc2cc1O
Show InChI InChI=1S/C28H31NO2/c1-28-11-9-21-22(6-5-18-14-26(30)27(31-2)15-23(18)21)25(28)8-7-24(28)19-4-3-17-10-12-29-16-20(17)13-19/h3-4,10,12-16,21-22,24-25,30H,5-9,11H2,1-2H3/t21-,22+,24+,25-,28+/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of Oslo

Curated by ChEMBL


Assay Description
Inhibition of porcine brain tubulin polymerization after 60 mins


Eur J Med Chem 85: 391-8 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.002
BindingDB Entry DOI: 10.7270/Q21V5GM9
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
BDBM50217501
PNG
(CHEMBL543873)
Show SMILES Cl.Cc1c(\C=C\CN2CCN(CC2)c2cc(F)cc(F)c2)cnn1-c1nccc(N)n1
Show InChI InChI=1S/C21H23F2N7.ClH/c1-15-16(14-26-30(15)21-25-5-4-20(24)27-21)3-2-6-28-7-9-29(10-8-28)19-12-17(22)11-18(23)13-19;/h2-5,11-14H,6-10H2,1H3,(H2,24,25,27);1H/b3-2+;
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n/an/a 1.11E+4n/an/an/an/an/an/a



Medicinal Chemistry Research Laboratory, Daiichi Pharmaceutical Co. Ltd., 16-13, Kita-kasai 1-chome, Edogawa-ku, 134, Tokyo, Japan. okihi10g@daiichipharm.co.jp

Curated by ChEMBL


Assay Description
Concentration of compound required to inhibit tubulin polymerization (Microtubule assembly) was determined by the turbidity formation after 20 min of...


Bioorg Med Chem Lett 12: 3191-3 (2002)


Article DOI: 10.1016/s0960-894x(02)00568-1
More data for this
Ligand-Target Pair
Tubulin


(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)


Article DOI: 10.1039/c5md00219b
BindingDB Entry DOI: 10.7270/Q2H41T8J
More data for this
Ligand-Target Pair
Tubulin


(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



Department of Chemistry, UMIST, Manchester, UK. lawrencenj1@cardiff.ac.uk

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)


Article DOI: 10.1016/s0960-894x(00)00596-5
More data for this
Ligand-Target Pair
Tubulin


(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)


Article DOI: 10.1039/c5md00219b
BindingDB Entry DOI: 10.7270/Q2H41T8J
More data for this
Ligand-Target Pair
Tubulin


(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



Department of Chemistry, UMIST, Manchester, UK. lawrencenj1@cardiff.ac.uk

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)


Article DOI: 10.1016/s0960-894x(00)00596-5
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
BDBM50014846
PNG
((S)-N-(5,6,7,9-tetrahydro-1,2,3,10-tetramethoxy-9-...)
Show SMILES COc1cc2CC[C@H](NC(C)=O)c3cc(=O)c(OC)ccc3-c2c(OC)c1OC
Show InChI InChI=1S/C22H25NO6/c1-12(24)23-16-8-6-13-10-19(27-3)21(28-4)22(29-5)20(13)14-7-9-18(26-2)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 2.93E+4n/an/an/an/an/an/a



Medicinal Chemistry Research Laboratory, Daiichi Pharmaceutical Co. Ltd., 16-13, Kita-kasai 1-chome, Edogawa-ku, 134, Tokyo, Japan. okihi10g@daiichipharm.co.jp

Curated by ChEMBL


Assay Description
Concentration of compound required to inhibit tubulin polymerization (Microtubule assembly) was determined by the turbidity formation after 20 min of...


Bioorg Med Chem Lett 12: 3191-3 (2002)


Article DOI: 10.1016/s0960-894x(02)00568-1
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Tubulin beta chain


(Sus scrofa)
BDBM50217502
PNG
(CHEMBL554449)
Show SMILES Cl.Cc1c(\C=C\CN2CCN(CC2)c2cccc(Cl)c2)cnn1-c1ncccn1
Show InChI InChI=1S/C21H23ClN6.ClH/c1-17-18(16-25-28(17)21-23-8-4-9-24-21)5-3-10-26-11-13-27(14-12-26)20-7-2-6-19(22)15-20;/h2-9,15-16H,10-14H2,1H3;1H/b5-3+;
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n/an/a 3.60E+4n/an/an/an/an/an/a



Medicinal Chemistry Research Laboratory, Daiichi Pharmaceutical Co. Ltd., 16-13, Kita-kasai 1-chome, Edogawa-ku, 134, Tokyo, Japan. okihi10g@daiichipharm.co.jp

Curated by ChEMBL


Assay Description
Concentration of compound required to inhibit tubulin polymerization (Microtubule assembly) was determined by the turbidity formation after 20 min of...


Bioorg Med Chem Lett 12: 3191-3 (2002)


Article DOI: 10.1016/s0960-894x(02)00568-1
More data for this
Ligand-Target Pair
Tubulin


(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



Department of Chemistry, UMIST, Manchester, UK. lawrencenj1@cardiff.ac.uk

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)


Article DOI: 10.1016/s0960-894x(00)00596-5
More data for this
Ligand-Target Pair
Tubulin


(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



Department of Chemistry, UMIST, Manchester, UK. lawrencenj1@cardiff.ac.uk

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)


Article DOI: 10.1016/s0960-894x(00)00596-5
More data for this
Ligand-Target Pair
Tubulin


(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)


Article DOI: 10.1016/j.bmcl.2003.07.003
BindingDB Entry DOI: 10.7270/Q2G73D48
More data for this
Ligand-Target Pair
Tubulin beta chain


(Sus scrofa)
BDBM50216137
PNG
(CHEMBL303103)
Show SMILES COc1ccc(cc1O)[C@H]1OCO[C@@H]1c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C19H22O7/c1-21-14-6-5-11(7-13(14)20)17-18(26-10-25-17)12-8-15(22-2)19(24-4)16(9-12)23-3/h5-9,17-18,20H,10H2,1-4H3/t17-,18-/m1/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



Institute of Molecular and Cellular Biosciences (IMCB), University of Tokyo, Japan.

Curated by ChEMBL


Assay Description
In vitro tubulin polymerization-inhibitory activity.


Bioorg Med Chem Lett 8: 1997-2000 (1998)


Article DOI: 10.1016/s0960-894x(98)00344-8
More data for this
Ligand-Target Pair
Tubulin


(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)


Article DOI: 10.1016/j.bmcl.2003.07.003
BindingDB Entry DOI: 10.7270/Q2G73D48
More data for this
Ligand-Target Pair
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