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PubMed code 26629859

Compile data set for download or QSAR
Found 5 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)		BDBM50135180
PNG
(CHEMBL3746143)
Show SMILES COc1cc(cc(OC)c1OC)C(=O)c1sc2c(C)cccc2c1NC(=O)CI
Show InChI InChI=1S/C21H20INO5S/c1-11-6-5-7-13-17(23-16(24)10-22)21(29-20(11)13)18(25)12-8-14(26-2)19(28-4)15(9-12)27-3/h5-9H,10H2,1-4H3,(H,23,24)
PDB

UniProtKB/TrEMBL

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UniChem

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PubMed
n/an/a 1.10E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Inhibition of bovine brain tubulin polymerization by spectrophotometry

Eur J Med Chem 108: 39-52 (2016)


Article DOI: 10.1016/j.ejmech.2015.11.022
BindingDB Entry DOI: 10.7270/Q2PN97GZ
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50135175
PNG
(CHEMBL490384)
Show SMILES COc1ccc2c(NC(=O)CI)c(oc2c1)C(=O)c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C21H20INO7/c1-26-12-5-6-13-14(9-12)30-21(18(13)23-17(24)10-22)19(25)11-7-15(27-2)20(29-4)16(8-11)28-3/h5-9H,10H2,1-4H3,(H,23,24)
PDB

UniProtKB/TrEMBL

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CHEMBL
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UniChem
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PubMed
n/an/a 1.80E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Inhibition of bovine brain tubulin polymerization by spectrophotometry

Eur J Med Chem 108: 39-52 (2016)


Article DOI: 10.1016/j.ejmech.2015.11.022
BindingDB Entry DOI: 10.7270/Q2PN97GZ
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50135177
PNG
(CHEMBL3747558)
Show SMILES COc1cc(cc(OC)c1OC)C(=O)c1c(NC(=O)CI)c2cccc(OC)c2n1C
Show InChI InChI=1S/C22H23IN2O6/c1-25-19-13(7-6-8-14(19)28-2)18(24-17(26)11-23)20(25)21(27)12-9-15(29-3)22(31-5)16(10-12)30-4/h6-10H,11H2,1-5H3,(H,24,26)
PDB

UniProtKB/TrEMBL

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PubMed
n/an/a 2.00E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Inhibition of bovine brain tubulin polymerization by spectrophotometry

Eur J Med Chem 108: 39-52 (2016)


Article DOI: 10.1016/j.ejmech.2015.11.022
BindingDB Entry DOI: 10.7270/Q2PN97GZ
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50135176
PNG
(CHEMBL3747491)
Show SMILES COc1cc(cc(OC)c1OC)C(=O)c1oc2ccccc2c1NC(=O)CI
Show InChI InChI=1S/C20H18INO6/c1-25-14-8-11(9-15(26-2)19(14)27-3)18(24)20-17(22-16(23)10-21)12-6-4-5-7-13(12)28-20/h4-9H,10H2,1-3H3,(H,22,23)
PDB

UniProtKB/TrEMBL

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PC cid
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UniChem

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Article
PubMed
n/an/a>2.00E+4n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Inhibition of bovine brain tubulin polymerization by spectrophotometry

Eur J Med Chem 108: 39-52 (2016)


Article DOI: 10.1016/j.ejmech.2015.11.022
BindingDB Entry DOI: 10.7270/Q2PN97GZ
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)		BDBM50135178
PNG
(CHEMBL3745749)
Show SMILES ICC(=O)Nc1c(oc2ccccc12)C(=O)c1ccccc1
Show InChI InChI=1S/C17H12INO3/c18-10-14(20)19-15-12-8-4-5-9-13(12)22-17(15)16(21)11-6-2-1-3-7-11/h1-9H,10H2,(H,19,20)
PDB

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a>2.00E+4n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Inhibition of bovine brain tubulin polymerization by spectrophotometry

Eur J Med Chem 108: 39-52 (2016)


Article DOI: 10.1016/j.ejmech.2015.11.022
BindingDB Entry DOI: 10.7270/Q2PN97GZ
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%