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Compile Data Set for Download or QSAR

Found 66 hits with Last Name = 'shin' and Initial = 'sy'   
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
Acetylcholinesterase


(Mus musculus (mouse))		BDBM50040212
PNG
(CHEMBL3359473)
Show SMILES Cl.COc1ccc(\C=C2/Oc3cc(OCCN4CCCCC4)ccc3C2=O)cc1OC
Show InChI InChI=1S/C24H27NO5.ClH/c1-27-20-9-6-17(14-22(20)28-2)15-23-24(26)19-8-7-18(16-21(19)30-23)29-13-12-25-10-4-3-5-11-25;/h6-9,14-16H,3-5,10-13H2,1-2H3;1H/b23-15-;
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n/an/a 400n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of ICR mouse brain AChE using acetylthiocholine iodide as substrate preincubated for 10 mins before substrate addition by modified Ellman'...

Bioorg Med Chem 23: 231-40 (2014)


Article DOI: 10.1016/j.bmc.2014.11.004
BindingDB Entry DOI: 10.7270/Q2V126FS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))		BDBM50040204
PNG
(CHEMBL3359481)
Show SMILES Cl.COc1ccc(\C=C2/Oc3cc(OCCN4CCCC4)ccc3C2=O)cc1OC
Show InChI InChI=1S/C23H25NO5.ClH/c1-26-19-8-5-16(13-21(19)27-2)14-22-23(25)18-7-6-17(15-20(18)29-22)28-12-11-24-9-3-4-10-24;/h5-8,13-15H,3-4,9-12H2,1-2H3;1H/b22-14-;
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n/an/a 750n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of ICR mouse brain AChE using acetylthiocholine iodide as substrate preincubated for 10 mins before substrate addition by modified Ellman'...

Bioorg Med Chem 23: 231-40 (2014)


Article DOI: 10.1016/j.bmc.2014.11.004
BindingDB Entry DOI: 10.7270/Q2V126FS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))		BDBM50040200
PNG
(CHEMBL3359485)
Show SMILES Cl.COc1cccc(\C=C2/Oc3cc(OCCCN4CCCCC4)ccc3C2=O)c1
Show InChI InChI=1S/C24H27NO4.ClH/c1-27-19-8-5-7-18(15-19)16-23-24(26)21-10-9-20(17-22(21)29-23)28-14-6-13-25-11-3-2-4-12-25;/h5,7-10,15-17H,2-4,6,11-14H2,1H3;1H/b23-16-;
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n/an/a 750n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of ICR mouse brain AChE using acetylthiocholine iodide as substrate preincubated for 10 mins before substrate addition by modified Ellman'...

Bioorg Med Chem 23: 231-40 (2014)


Article DOI: 10.1016/j.bmc.2014.11.004
BindingDB Entry DOI: 10.7270/Q2V126FS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))		BDBM50040107
PNG
(CHEMBL3359496)
Show SMILES Cl.COc1ccc(\C=C2/Oc3cc(OCCCN4CCCCC4)ccc3C2=O)cc1OC
Show InChI InChI=1S/C25H29NO5.ClH/c1-28-21-10-7-18(15-23(21)29-2)16-24-25(27)20-9-8-19(17-22(20)31-24)30-14-6-13-26-11-4-3-5-12-26;/h7-10,15-17H,3-6,11-14H2,1-2H3;1H/b24-16-;
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n/an/a 890n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of ICR mouse brain AChE using acetylthiocholine iodide as substrate preincubated for 10 mins before substrate addition by modified Ellman'...

Bioorg Med Chem 23: 231-40 (2014)


Article DOI: 10.1016/j.bmc.2014.11.004
BindingDB Entry DOI: 10.7270/Q2V126FS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))		BDBM50040213
PNG
(CHEMBL3359472)
Show SMILES Cl.COc1ccc(\C=C2/Oc3cc(OCCN4CCCCC4)ccc3C2=O)cc1
Show InChI InChI=1S/C23H25NO4.ClH/c1-26-18-7-5-17(6-8-18)15-22-23(25)20-10-9-19(16-21(20)28-22)27-14-13-24-11-3-2-4-12-24;/h5-10,15-16H,2-4,11-14H2,1H3;1H/b22-15-;
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n/an/a 900n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of ICR mouse brain AChE using acetylthiocholine iodide as substrate preincubated for 10 mins before substrate addition by modified Ellman'...

Bioorg Med Chem 23: 231-40 (2014)


Article DOI: 10.1016/j.bmc.2014.11.004
BindingDB Entry DOI: 10.7270/Q2V126FS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))		BDBM50040207
PNG
(CHEMBL3359478)
Show SMILES Cl.COc1cccc(\C=C2/Oc3cc(OCCN4CCCC4)ccc3C2=O)c1OC
Show InChI InChI=1S/C23H25NO5.ClH/c1-26-19-7-5-6-16(23(19)27-2)14-21-22(25)18-9-8-17(15-20(18)29-21)28-13-12-24-10-3-4-11-24;/h5-9,14-15H,3-4,10-13H2,1-2H3;1H/b21-14-;
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n/an/a 990n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of ICR mouse brain AChE using acetylthiocholine iodide as substrate preincubated for 10 mins before substrate addition by modified Ellman'...

Bioorg Med Chem 23: 231-40 (2014)


Article DOI: 10.1016/j.bmc.2014.11.004
BindingDB Entry DOI: 10.7270/Q2V126FS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))		BDBM50040160
PNG
(CHEMBL3359492)
Show SMILES Cl.COc1ccc(\C=C2/Oc3cc(OCCCN4CCCC4)ccc3C2=O)cc1OC
Show InChI InChI=1S/C24H27NO5.ClH/c1-27-20-9-6-17(14-22(20)28-2)15-23-24(26)19-8-7-18(16-21(19)30-23)29-13-5-12-25-10-3-4-11-25;/h6-9,14-16H,3-5,10-13H2,1-2H3;1H/b23-15-;
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n/an/a 1.03E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of ICR mouse brain AChE using acetylthiocholine iodide as substrate preincubated for 10 mins before substrate addition by modified Ellman'...

Bioorg Med Chem 23: 231-40 (2014)


Article DOI: 10.1016/j.bmc.2014.11.004
BindingDB Entry DOI: 10.7270/Q2V126FS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))		BDBM50040164
PNG
(CHEMBL3359489)
Show SMILES Cl.COc1cccc(\C=C2/Oc3cc(OCCCN4CCCC4)ccc3C2=O)c1OC
Show InChI InChI=1S/C24H27NO5.ClH/c1-27-20-8-5-7-17(24(20)28-2)15-22-23(26)19-10-9-18(16-21(19)30-22)29-14-6-13-25-11-3-4-12-25;/h5,7-10,15-16H,3-4,6,11-14H2,1-2H3;1H/b22-15-;
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n/an/a 1.05E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of ICR mouse brain AChE using acetylthiocholine iodide as substrate preincubated for 10 mins before substrate addition by modified Ellman'...

Bioorg Med Chem 23: 231-40 (2014)


Article DOI: 10.1016/j.bmc.2014.11.004
BindingDB Entry DOI: 10.7270/Q2V126FS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))		BDBM50040211
PNG
(CHEMBL3359474)
Show SMILES Cl.COc1cc(\C=C2/Oc3cc(OCCN4CCCCC4)ccc3C2=O)cc(OC)c1OC
Show InChI InChI=1S/C25H29NO6.ClH/c1-28-22-14-17(15-23(29-2)25(22)30-3)13-21-24(27)19-8-7-18(16-20(19)32-21)31-12-11-26-9-5-4-6-10-26;/h7-8,13-16H,4-6,9-12H2,1-3H3;1H/b21-13-;
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n/an/a 1.12E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of ICR mouse brain AChE using acetylthiocholine iodide as substrate preincubated for 10 mins before substrate addition by modified Ellman'...

Bioorg Med Chem 23: 231-40 (2014)


Article DOI: 10.1016/j.bmc.2014.11.004
BindingDB Entry DOI: 10.7270/Q2V126FS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))		BDBM50040214
PNG
(CHEMBL3359471)
Show SMILES Cl.COc1cccc(\C=C2/Oc3cc(OCCN4CCCCC4)ccc3C2=O)c1
Show InChI InChI=1S/C23H25NO4.ClH/c1-26-18-7-5-6-17(14-18)15-22-23(25)20-9-8-19(16-21(20)28-22)27-13-12-24-10-3-2-4-11-24;/h5-9,14-16H,2-4,10-13H2,1H3;1H/b22-15-;
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n/an/a 1.15E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of ICR mouse brain AChE using acetylthiocholine iodide as substrate preincubated for 10 mins before substrate addition by modified Ellman'...

Bioorg Med Chem 23: 231-40 (2014)


Article DOI: 10.1016/j.bmc.2014.11.004
BindingDB Entry DOI: 10.7270/Q2V126FS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))		BDBM50040118
PNG
(CHEMBL3359495)
Show SMILES Cl.COc1ccc(\C=C2/Oc3cc(OCCCCCN4CCCCC4)ccc3C2=O)cc1OC
Show InChI InChI=1S/C27H33NO5.ClH/c1-30-23-12-9-20(17-25(23)31-2)18-26-27(29)22-11-10-21(19-24(22)33-26)32-16-8-4-7-15-28-13-5-3-6-14-28;/h9-12,17-19H,3-8,13-16H2,1-2H3;1H/b26-18-;
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n/an/a 1.26E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of ICR mouse brain AChE using acetylthiocholine iodide as substrate preincubated for 10 mins before substrate addition by modified Ellman'...

Bioorg Med Chem 23: 231-40 (2014)


Article DOI: 10.1016/j.bmc.2014.11.004
BindingDB Entry DOI: 10.7270/Q2V126FS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))		BDBM50040205
PNG
(CHEMBL3359480)
Show SMILES Cl.COc1ccc(OC)c(\C=C2/Oc3cc(OCCN4CCCC4)ccc3C2=O)c1
Show InChI InChI=1S/C23H25NO5.ClH/c1-26-17-6-8-20(27-2)16(13-17)14-22-23(25)19-7-5-18(15-21(19)29-22)28-12-11-24-9-3-4-10-24;/h5-8,13-15H,3-4,9-12H2,1-2H3;1H/b22-14-;
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n/an/a 1.49E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of ICR mouse brain AChE using acetylthiocholine iodide as substrate preincubated for 10 mins before substrate addition by modified Ellman'...

Bioorg Med Chem 23: 231-40 (2014)


Article DOI: 10.1016/j.bmc.2014.11.004
BindingDB Entry DOI: 10.7270/Q2V126FS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))		BDBM50040122
PNG
(CHEMBL3359494)
Show SMILES Cl.COc1ccc(\C=C2/Oc3cc(OCCCCN4CCCCC4)ccc3C2=O)cc1OC
Show InChI InChI=1S/C26H31NO5.ClH/c1-29-22-11-8-19(16-24(22)30-2)17-25-26(28)21-10-9-20(18-23(21)32-25)31-15-7-6-14-27-12-4-3-5-13-27;/h8-11,16-18H,3-7,12-15H2,1-2H3;1H/b25-17-;
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n/an/a 1.52E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of ICR mouse brain AChE using acetylthiocholine iodide as substrate preincubated for 10 mins before substrate addition by modified Ellman'...

Bioorg Med Chem 23: 231-40 (2014)


Article DOI: 10.1016/j.bmc.2014.11.004
BindingDB Entry DOI: 10.7270/Q2V126FS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))		BDBM50040201
PNG
(CHEMBL3359484)
Show SMILES Cl.COc1cc(\C=C2/Oc3cc(OCCN4CCCC4)ccc3C2=O)cc(OC)c1OC
Show InChI InChI=1S/C24H27NO6.ClH/c1-27-21-13-16(14-22(28-2)24(21)29-3)12-20-23(26)18-7-6-17(15-19(18)31-20)30-11-10-25-8-4-5-9-25;/h6-7,12-15H,4-5,8-11H2,1-3H3;1H/b20-12-;
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n/an/a 1.56E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of ICR mouse brain AChE using acetylthiocholine iodide as substrate preincubated for 10 mins before substrate addition by modified Ellman'...

Bioorg Med Chem 23: 231-40 (2014)


Article DOI: 10.1016/j.bmc.2014.11.004
BindingDB Entry DOI: 10.7270/Q2V126FS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))		BDBM50040209
PNG
(CHEMBL3359476)
Show SMILES Cl.COc1cccc(\C=C2/Oc3cc(OCCN4CCCC4)ccc3C2=O)c1
Show InChI InChI=1S/C22H23NO4.ClH/c1-25-17-6-4-5-16(13-17)14-21-22(24)19-8-7-18(15-20(19)27-21)26-12-11-23-9-2-3-10-23;/h4-8,13-15H,2-3,9-12H2,1H3;1H/b21-14-;
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n/an/a 1.61E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of ICR mouse brain AChE using acetylthiocholine iodide as substrate preincubated for 10 mins before substrate addition by modified Ellman'...

Bioorg Med Chem 23: 231-40 (2014)


Article DOI: 10.1016/j.bmc.2014.11.004
BindingDB Entry DOI: 10.7270/Q2V126FS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))		BDBM50040206
PNG
(CHEMBL3359479)
Show SMILES Cl.COc1ccc(\C=C2/Oc3cc(OCCN4CCCC4)ccc3C2=O)c(OC)c1
Show InChI InChI=1S/C23H25NO5.ClH/c1-26-17-6-5-16(20(14-17)27-2)13-22-23(25)19-8-7-18(15-21(19)29-22)28-12-11-24-9-3-4-10-24;/h5-8,13-15H,3-4,9-12H2,1-2H3;1H/b22-13-;
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n/an/a 1.61E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of ICR mouse brain AChE using acetylthiocholine iodide as substrate preincubated for 10 mins before substrate addition by modified Ellman'...

Bioorg Med Chem 23: 231-40 (2014)


Article DOI: 10.1016/j.bmc.2014.11.004
BindingDB Entry DOI: 10.7270/Q2V126FS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))		BDBM50040163
PNG
(CHEMBL3359490)
Show SMILES Cl.COc1ccc(\C=C2/Oc3cc(OCCCN4CCCC4)ccc3C2=O)c(OC)c1
Show InChI InChI=1S/C24H27NO5.ClH/c1-27-18-7-6-17(21(15-18)28-2)14-23-24(26)20-9-8-19(16-22(20)30-23)29-13-5-12-25-10-3-4-11-25;/h6-9,14-16H,3-5,10-13H2,1-2H3;1H/b23-14-;
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n/an/a 1.66E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of ICR mouse brain AChE using acetylthiocholine iodide as substrate preincubated for 10 mins before substrate addition by modified Ellman'...

Bioorg Med Chem 23: 231-40 (2014)


Article DOI: 10.1016/j.bmc.2014.11.004
BindingDB Entry DOI: 10.7270/Q2V126FS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))		BDBM10404
PNG
((1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetrac...)
Show SMILES COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 |r,c:12|
Show InChI InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1
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n/an/a 2.08E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of ICR mouse brain AChE using acetylthiocholine iodide as substrate preincubated for 10 mins before substrate addition by modified Ellman'...

Bioorg Med Chem 23: 231-40 (2014)


Article DOI: 10.1016/j.bmc.2014.11.004
BindingDB Entry DOI: 10.7270/Q2V126FS
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Acetylcholinesterase


(Mus musculus (mouse))		BDBM50040208
PNG
(CHEMBL3359477)
Show SMILES Cl.COc1ccc(\C=C2/Oc3cc(OCCN4CCCC4)ccc3C2=O)cc1
Show InChI InChI=1S/C22H23NO4.ClH/c1-25-17-6-4-16(5-7-17)14-21-22(24)19-9-8-18(15-20(19)27-21)26-13-12-23-10-2-3-11-23;/h4-9,14-15H,2-3,10-13H2,1H3;1H/b21-14-;
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n/an/a 2.38E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of ICR mouse brain AChE using acetylthiocholine iodide as substrate preincubated for 10 mins before substrate addition by modified Ellman'...

Bioorg Med Chem 23: 231-40 (2014)


Article DOI: 10.1016/j.bmc.2014.11.004
BindingDB Entry DOI: 10.7270/Q2V126FS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))		BDBM50040215
PNG
(CHEMBL3359470)
Show SMILES Cl.COc1ccccc1\C=C1/Oc2cc(OCCN3CCCCC3)ccc2C1=O
Show InChI InChI=1S/C23H25NO4.ClH/c1-26-20-8-4-3-7-17(20)15-22-23(25)19-10-9-18(16-21(19)28-22)27-14-13-24-11-5-2-6-12-24;/h3-4,7-10,15-16H,2,5-6,11-14H2,1H3;1H/b22-15-;
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n/an/a 2.52E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of ICR mouse brain AChE using acetylthiocholine iodide as substrate preincubated for 10 mins before substrate addition by modified Ellman'...

Bioorg Med Chem 23: 231-40 (2014)


Article DOI: 10.1016/j.bmc.2014.11.004
BindingDB Entry DOI: 10.7270/Q2V126FS
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))		BDBM23408
PNG
(2-(3,4-dihydroxyphenyl)-3,5,6,7-tetrahydroxy-4H-ch...)
Show SMILES Oc1ccc(cc1O)-c1oc2cc(O)c(O)c(O)c2c(=O)c1O
Show InChI InChI=1S/C15H10O8/c16-6-2-1-5(3-7(6)17)15-14(22)13(21)10-9(23-15)4-8(18)11(19)12(10)20/h1-4,16-20,22H
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n/an/a 2.62E+3n/an/an/an/an/an/a



Konkuk University



Assay Description
The kinase assay was performed using the EMD Millipore KinaseProfiler service assay protocol. Aurora B kinase was supplied by EMD Millipore Corp. The...

Chem Biol Drug Des 85: 574-85 (2015)


Article DOI: 10.1111/cbdd.12445
BindingDB Entry DOI: 10.7270/Q2M61J08
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))		BDBM7457
PNG
(2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-4H-chromen-4...)
Show SMILES Oc1ccc2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O
Show InChI InChI=1S/C15H10O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,16-18,20H
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n/an/a 2.63E+3n/an/an/an/an/an/a



Konkuk University



Assay Description
The kinase assay was performed using the EMD Millipore KinaseProfiler service assay protocol. Aurora B kinase was supplied by EMD Millipore Corp. The...

Chem Biol Drug Des 85: 574-85 (2015)


Article DOI: 10.1111/cbdd.12445
BindingDB Entry DOI: 10.7270/Q2M61J08
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))		BDBM153269
PNG
(3,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)chromen...)
Show SMILES COc1cc(ccc1O)-c1oc2cc(O)ccc2c(=O)c1O
Show InChI InChI=1S/C16H12O6/c1-21-13-6-8(2-5-11(13)18)16-15(20)14(19)10-4-3-9(17)7-12(10)22-16/h2-7,17-18,20H,1H3
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n/an/a 2.85E+3n/an/an/an/an/an/a



Konkuk University



Assay Description
The kinase assay was performed using the EMD Millipore KinaseProfiler service assay protocol. Aurora B kinase was supplied by EMD Millipore Corp. The...

Chem Biol Drug Des 85: 574-85 (2015)


Article DOI: 10.1111/cbdd.12445
BindingDB Entry DOI: 10.7270/Q2M61J08
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))		BDBM50040210
PNG
(CHEMBL3359475)
Show SMILES Cl.COc1ccccc1\C=C1/Oc2cc(OCCN3CCCC3)ccc2C1=O
Show InChI InChI=1S/C22H23NO4.ClH/c1-25-19-7-3-2-6-16(19)14-21-22(24)18-9-8-17(15-20(18)27-21)26-13-12-23-10-4-5-11-23;/h2-3,6-9,14-15H,4-5,10-13H2,1H3;1H/b21-14-;
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n/an/a 2.87E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of ICR mouse brain AChE using acetylthiocholine iodide as substrate preincubated for 10 mins before substrate addition by modified Ellman'...

Bioorg Med Chem 23: 231-40 (2014)


Article DOI: 10.1016/j.bmc.2014.11.004
BindingDB Entry DOI: 10.7270/Q2V126FS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))		BDBM50040172
PNG
(CHEMBL3359488)
Show SMILES Cl.COc1ccc(\C=C2/Oc3cc(OCCCN4CCCC4)ccc3C2=O)cc1
Show InChI InChI=1S/C23H25NO4.ClH/c1-26-18-7-5-17(6-8-18)15-22-23(25)20-10-9-19(16-21(20)28-22)27-14-4-13-24-11-2-3-12-24;/h5-10,15-16H,2-4,11-14H2,1H3;1H/b22-15-;
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n/an/a 3.31E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of ICR mouse brain AChE using acetylthiocholine iodide as substrate preincubated for 10 mins before substrate addition by modified Ellman'...

Bioorg Med Chem 23: 231-40 (2014)


Article DOI: 10.1016/j.bmc.2014.11.004
BindingDB Entry DOI: 10.7270/Q2V126FS
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))		BDBM23411
PNG
(5,6,7-trihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-...)
Show SMILES Oc1ccc(cc1)-c1cc(=O)c2c(O)c(O)c(O)cc2o1
Show InChI InChI=1S/C15H10O6/c16-8-3-1-7(2-4-8)11-5-9(17)13-12(21-11)6-10(18)14(19)15(13)20/h1-6,16,18-20H
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n/an/a 3.85E+3n/an/an/an/an/an/a



Konkuk University



Assay Description
The kinase assay was performed using the EMD Millipore KinaseProfiler service assay protocol. Aurora B kinase was supplied by EMD Millipore Corp. The...

Chem Biol Drug Des 85: 574-85 (2015)


Article DOI: 10.1111/cbdd.12445
BindingDB Entry DOI: 10.7270/Q2M61J08
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))		BDBM23414
PNG
(5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-4H-chr...)
Show SMILES COc1ccc(cc1O)-c1cc(=O)c2c(O)cc(O)cc2o1
Show InChI InChI=1S/C16H12O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-7,17-19H,1H3
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n/an/a 3.86E+3n/an/an/an/an/an/a



Konkuk University



Assay Description
The kinase assay was performed using the EMD Millipore KinaseProfiler service assay protocol. Aurora B kinase was supplied by EMD Millipore Corp. The...

Chem Biol Drug Des 85: 574-85 (2015)


Article DOI: 10.1111/cbdd.12445
BindingDB Entry DOI: 10.7270/Q2M61J08
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))		BDBM7459
PNG
(2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-chromen-4...)
Show SMILES Oc1cc(O)c2c(c1)oc(cc2=O)-c1ccc(O)c(O)c1
Show InChI InChI=1S/C15H10O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-6,16-19H
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n/an/a 3.88E+3n/an/an/an/an/an/a



Konkuk University



Assay Description
The kinase assay was performed using the EMD Millipore KinaseProfiler service assay protocol. Aurora B kinase was supplied by EMD Millipore Corp. The...

Chem Biol Drug Des 85: 574-85 (2015)


Article DOI: 10.1111/cbdd.12445
BindingDB Entry DOI: 10.7270/Q2M61J08
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))		BDBM153266
PNG
(5,7-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy...)
Show SMILES C[C@@H]1O[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)-c2cc(O)c(O)c(O)c2)[C@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1S/C21H20O12/c1-6-14(26)17(29)18(30)21(31-6)33-20-16(28)13-9(23)4-8(22)5-12(13)32-19(20)7-2-10(24)15(27)11(25)3-7/h2-6,14,17-18,21-27,29-30H,1H3/t6-,14-,17+,18+,21-/m0/s1
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n/an/a 3.89E+3n/an/an/an/an/an/a



Konkuk University



Assay Description
The kinase assay was performed using the EMD Millipore KinaseProfiler service assay protocol. Aurora B kinase was supplied by EMD Millipore Corp. The...

Chem Biol Drug Des 85: 574-85 (2015)


Article DOI: 10.1111/cbdd.12445
BindingDB Entry DOI: 10.7270/Q2M61J08
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))		BDBM7458
PNG
(5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one...)
Show SMILES Oc1ccc(cc1)-c1cc(=O)c2c(O)cc(O)cc2o1
Show InChI InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H
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n/an/a 3.96E+3n/an/an/an/an/an/a



Konkuk University



Assay Description
The kinase assay was performed using the EMD Millipore KinaseProfiler service assay protocol. Aurora B kinase was supplied by EMD Millipore Corp. The...

Chem Biol Drug Des 85: 574-85 (2015)


Article DOI: 10.1111/cbdd.12445
BindingDB Entry DOI: 10.7270/Q2M61J08
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))		BDBM7460
PNG
(2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chrome...)
Show SMILES Oc1cc(O)c2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O
Show InChI InChI=1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H
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n/an/a 3.96E+3n/an/an/an/an/an/a



Konkuk University



Assay Description
The kinase assay was performed using the EMD Millipore KinaseProfiler service assay protocol. Aurora B kinase was supplied by EMD Millipore Corp. The...

Chem Biol Drug Des 85: 574-85 (2015)


Article DOI: 10.1111/cbdd.12445
BindingDB Entry DOI: 10.7270/Q2M61J08
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))		BDBM50241084
PNG
(3'-Methoxyapigenin | 4',5,7-trihydroxy-3'-methoxyf...)
Show SMILES COc1cc(ccc1O)-c1cc(=O)c2c(O)cc(O)cc2o1
Show InChI InChI=1S/C16H12O6/c1-21-14-4-8(2-3-10(14)18)13-7-12(20)16-11(19)5-9(17)6-15(16)22-13/h2-7,17-19H,1H3
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n/an/a 3.98E+3n/an/an/an/an/an/a



Konkuk University



Assay Description
The kinase assay was performed using the EMD Millipore KinaseProfiler service assay protocol. Aurora B kinase was supplied by EMD Millipore Corp. The...

Chem Biol Drug Des 85: 574-85 (2015)


Article DOI: 10.1111/cbdd.12445
BindingDB Entry DOI: 10.7270/Q2M61J08
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))		BDBM15236
PNG
(3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-4H-chr...)
Show SMILES Oc1cc(O)c2c(c1)oc(-c1cc(O)c(O)c(O)c1)c(O)c2=O
Show InChI InChI=1S/C15H10O8/c16-6-3-7(17)11-10(4-6)23-15(14(22)13(11)21)5-1-8(18)12(20)9(19)2-5/h1-4,16-20,22H
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n/an/a 3.98E+3n/an/an/an/an/an/a



Konkuk University



Assay Description
The kinase assay was performed using the EMD Millipore KinaseProfiler service assay protocol. Aurora B kinase was supplied by EMD Millipore Corp. The...

Chem Biol Drug Des 85: 574-85 (2015)


Article DOI: 10.1111/cbdd.12445
BindingDB Entry DOI: 10.7270/Q2M61J08
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))		BDBM7462
PNG
(3,5,7-trihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-...)
Show SMILES Oc1ccc(cc1)-c1oc2cc(O)cc(O)c2c(=O)c1O
Show InChI InChI=1S/C15H10O6/c16-8-3-1-7(2-4-8)15-14(20)13(19)12-10(18)5-9(17)6-11(12)21-15/h1-6,16-18,20H
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n/an/a 4.03E+3n/an/an/an/an/an/a



Konkuk University



Assay Description
The kinase assay was performed using the EMD Millipore KinaseProfiler service assay protocol. Aurora B kinase was supplied by EMD Millipore Corp. The...

Chem Biol Drug Des 85: 574-85 (2015)


Article DOI: 10.1111/cbdd.12445
BindingDB Entry DOI: 10.7270/Q2M61J08
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))		BDBM50009001
PNG
(5,6,7-Trihydroxyflavone | 5,6,7-trihydroxy-2-pheny...)
Show SMILES Oc1cc2oc(cc(=O)c2c(O)c1O)-c1ccccc1
Show InChI InChI=1S/C15H10O5/c16-9-6-11(8-4-2-1-3-5-8)20-12-7-10(17)14(18)15(19)13(9)12/h1-7,17-19H
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n/an/a 4.06E+3n/an/an/an/an/an/a



Konkuk University



Assay Description
The kinase assay was performed using the EMD Millipore KinaseProfiler service assay protocol. Aurora B kinase was supplied by EMD Millipore Corp. The...

Chem Biol Drug Des 85: 574-85 (2015)


Article DOI: 10.1111/cbdd.12445
BindingDB Entry DOI: 10.7270/Q2M61J08
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))		BDBM26655
PNG
(2-(3,4-dihydroxyphenyl)-3,5,7,8-tetrahydroxy-4H-ch...)
Show SMILES Oc1ccc(cc1O)-c1oc2c(O)c(O)cc(O)c2c(=O)c1O
Show InChI InChI=1S/C15H10O8/c16-6-2-1-5(3-7(6)17)14-13(22)12(21)10-8(18)4-9(19)11(20)15(10)23-14/h1-4,16-20,22H
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n/an/a 4.10E+3n/an/an/an/an/an/a



Konkuk University



Assay Description
The kinase assay was performed using the EMD Millipore KinaseProfiler service assay protocol. Aurora B kinase was supplied by EMD Millipore Corp. The...

Chem Biol Drug Des 85: 574-85 (2015)


Article DOI: 10.1111/cbdd.12445
BindingDB Entry DOI: 10.7270/Q2M61J08
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))		BDBM50040180
PNG
(CHEMBL3359487)
Show SMILES Cl.COc1cccc(\C=C2/Oc3cc(OCCCN4CCCC4)ccc3C2=O)c1
Show InChI InChI=1S/C23H25NO4.ClH/c1-26-18-7-4-6-17(14-18)15-22-23(25)20-9-8-19(16-21(20)28-22)27-13-5-12-24-10-2-3-11-24;/h4,6-9,14-16H,2-3,5,10-13H2,1H3;1H/b22-15-;
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n/an/a 4.20E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of ICR mouse brain AChE using acetylthiocholine iodide as substrate preincubated for 10 mins before substrate addition by modified Ellman'...

Bioorg Med Chem 23: 231-40 (2014)


Article DOI: 10.1016/j.bmc.2014.11.004
BindingDB Entry DOI: 10.7270/Q2V126FS
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))		BDBM50187668
PNG
(3-Hydroxyflavone | 3-Hydroxyflavone (12) | 3-hydro...)
Show SMILES Oc1c(oc2ccccc2c1=O)-c1ccccc1
Show InChI InChI=1S/C15H10O3/c16-13-11-8-4-5-9-12(11)18-15(14(13)17)10-6-2-1-3-7-10/h1-9,17H
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n/an/a 4.29E+3n/an/an/an/an/an/a



Konkuk University



Assay Description
The kinase assay was performed using the EMD Millipore KinaseProfiler service assay protocol. Aurora B kinase was supplied by EMD Millipore Corp. The...

Chem Biol Drug Des 85: 574-85 (2015)


Article DOI: 10.1111/cbdd.12445
BindingDB Entry DOI: 10.7270/Q2M61J08
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))		BDBM23409
PNG
(3,5,7-trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4H-...)
Show SMILES COc1cc(ccc1O)-c1oc2cc(O)cc(O)c2c(=O)c1O
Show InChI InChI=1S/C16H12O7/c1-22-11-4-7(2-3-9(11)18)16-15(21)14(20)13-10(19)5-8(17)6-12(13)23-16/h2-6,17-19,21H,1H3
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n/an/a 4.34E+3n/an/an/an/an/an/a



Konkuk University



Assay Description
The kinase assay was performed using the EMD Millipore KinaseProfiler service assay protocol. Aurora B kinase was supplied by EMD Millipore Corp. The...

Chem Biol Drug Des 85: 574-85 (2015)


Article DOI: 10.1111/cbdd.12445
BindingDB Entry DOI: 10.7270/Q2M61J08
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))		BDBM50040157
PNG
(CHEMBL3359493)
Show SMILES Cl.COc1cc(OC)cc(\C=C2/Oc3cc(OCCCN4CCCC4)ccc3C2=O)c1
Show InChI InChI=1S/C24H27NO5/c1-27-19-12-17(13-20(15-19)28-2)14-23-24(26)21-7-6-18(16-22(21)30-23)29-11-5-10-25-8-3-4-9-25/h6-7,12-16H,3-5,8-11H2,1-2H3/b23-14-
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n/an/a 4.63E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of ICR mouse brain AChE using acetylthiocholine iodide as substrate preincubated for 10 mins before substrate addition by modified Ellman'...

Bioorg Med Chem 23: 231-40 (2014)


Article DOI: 10.1016/j.bmc.2014.11.004
BindingDB Entry DOI: 10.7270/Q2V126FS
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))		BDBM26658
PNG
(2-(2,4-dihydroxyphenyl)-3,5,7-trihydroxy-1-benzopy...)
Show SMILES Oc1ccc(c(O)c1)-c1oc2cc(O)cc(O)c2c(=O)c1O
Show InChI InChI=1S/C15H10O7/c16-6-1-2-8(9(18)3-6)15-14(21)13(20)12-10(19)4-7(17)5-11(12)22-15/h1-5,16-19,21H
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n/an/a 4.71E+3n/an/an/an/an/an/a



Konkuk University



Assay Description
The kinase assay was performed using the EMD Millipore KinaseProfiler service assay protocol. Aurora B kinase was supplied by EMD Millipore Corp. The...

Chem Biol Drug Des 85: 574-85 (2015)


Article DOI: 10.1111/cbdd.12445
BindingDB Entry DOI: 10.7270/Q2M61J08
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))		BDBM50040162
PNG
(CHEMBL3359491)
Show SMILES Cl.COc1ccc(OC)c(\C=C2/Oc3cc(OCCCN4CCCC4)ccc3C2=O)c1
Show InChI InChI=1S/C24H27NO5.ClH/c1-27-18-7-9-21(28-2)17(14-18)15-23-24(26)20-8-6-19(16-22(20)30-23)29-13-5-12-25-10-3-4-11-25;/h6-9,14-16H,3-5,10-13H2,1-2H3;1H/b23-15-;
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n/an/a 4.74E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of ICR mouse brain AChE using acetylthiocholine iodide as substrate preincubated for 10 mins before substrate addition by modified Ellman'...

Bioorg Med Chem 23: 231-40 (2014)


Article DOI: 10.1016/j.bmc.2014.11.004
BindingDB Entry DOI: 10.7270/Q2V126FS
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))		BDBM50040203
PNG
(CHEMBL3359482)
Show SMILES Cl.COc1cc(OC)cc(\C=C2/Oc3cc(OCCN4CCCC4)ccc3C2=O)c1
Show InChI InChI=1S/C23H25NO5.ClH/c1-26-18-11-16(12-19(14-18)27-2)13-22-23(25)20-6-5-17(15-21(20)29-22)28-10-9-24-7-3-4-8-24;/h5-6,11-15H,3-4,7-10H2,1-2H3;1H/b22-13-;
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n/an/a 4.81E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of ICR mouse brain AChE using acetylthiocholine iodide as substrate preincubated for 10 mins before substrate addition by modified Ellman'...

Bioorg Med Chem 23: 231-40 (2014)


Article DOI: 10.1016/j.bmc.2014.11.004
BindingDB Entry DOI: 10.7270/Q2V126FS
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))		BDBM50338975
PNG
(2-(3,4-dimethoxyphenyl)-5,6,7-trimethoxy-4H-chrome...)
Show SMILES COc1ccc(cc1OC)-c1cc(=O)c2c(OC)c(OC)c(OC)cc2o1
Show InChI InChI=1S/C20H20O7/c1-22-13-7-6-11(8-15(13)23-2)14-9-12(21)18-16(27-14)10-17(24-3)19(25-4)20(18)26-5/h6-10H,1-5H3
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n/an/a 5.31E+3n/an/an/an/an/an/a



Konkuk University



Assay Description
The kinase assay was performed using the EMD Millipore KinaseProfiler service assay protocol. Aurora B kinase was supplied by EMD Millipore Corp. The...

Chem Biol Drug Des 85: 574-85 (2015)


Article DOI: 10.1111/cbdd.12445
BindingDB Entry DOI: 10.7270/Q2M61J08
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Mus musculus (mouse))		BDBM50040186
PNG
(CHEMBL3359486)
Show SMILES Cl.COc1ccccc1\C=C1/Oc2cc(OCCCN3CCCC3)ccc2C1=O
Show InChI InChI=1S/C23H25NO4.ClH/c1-26-20-8-3-2-7-17(20)15-22-23(25)19-10-9-18(16-21(19)28-22)27-14-6-13-24-11-4-5-12-24;/h2-3,7-10,15-16H,4-6,11-14H2,1H3;1H/b22-15-;
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n/an/a 5.93E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of ICR mouse brain AChE using acetylthiocholine iodide as substrate preincubated for 10 mins before substrate addition by modified Ellman'...

Bioorg Med Chem 23: 231-40 (2014)


Article DOI: 10.1016/j.bmc.2014.11.004
BindingDB Entry DOI: 10.7270/Q2V126FS
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))		BDBM50325674
PNG
(3,5,7-trihydroxy-2-(3-hydroxy-4-methoxyphenyl)-4H-...)
Show SMILES COc1ccc(cc1O)-c1oc2cc(O)cc(O)c2c(=O)c1O
Show InChI InChI=1S/C16H12O7/c1-22-11-3-2-7(4-9(11)18)16-15(21)14(20)13-10(19)5-8(17)6-12(13)23-16/h2-6,17-19,21H,1H3
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n/an/a 7.39E+3n/an/an/an/an/an/a



Konkuk University



Assay Description
The kinase assay was performed using the EMD Millipore KinaseProfiler service assay protocol. Aurora B kinase was supplied by EMD Millipore Corp. The...

Chem Biol Drug Des 85: 574-85 (2015)


Article DOI: 10.1111/cbdd.12445
BindingDB Entry DOI: 10.7270/Q2M61J08
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))		BDBM50533243
PNG
(CHEMBL4514298)
Show SMILES COc1ccc(cc1)C1CC(=NN1C(=S)Nc1cccc(OC)c1)c1ccc2ccccc2c1O |c:11|
Show InChI InChI=1S/C28H25N3O3S/c1-33-21-13-10-19(11-14-21)26-17-25(24-15-12-18-6-3-4-9-23(18)27(24)32)30-31(26)28(35)29-20-7-5-8-22(16-20)34-2/h3-16,26,32H,17H2,1-2H3,(H,29,35)
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n/an/a 8.53E+3n/an/an/an/an/an/a



Konkuk University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant His-tagged aurora B expressed in baculovirus infected Sf21 insect cells by Western blot analysis

Bioorg Med Chem Lett 26: 4301-9 (2016)


Article DOI: 10.1016/j.bmcl.2016.07.037
BindingDB Entry DOI: 10.7270/Q2DF6VQV
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))		BDBM50533243
PNG
(CHEMBL4514298)
Show SMILES COc1ccc(cc1)C1CC(=NN1C(=S)Nc1cccc(OC)c1)c1ccc2ccccc2c1O |c:11|
Show InChI InChI=1S/C28H25N3O3S/c1-33-21-13-10-19(11-14-21)26-17-25(24-15-12-18-6-3-4-9-23(18)27(24)32)30-31(26)28(35)29-20-7-5-8-22(16-20)34-2/h3-16,26,32H,17H2,1-2H3,(H,29,35)
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n/an/a 8.53E+3n/an/an/an/an/an/a



Konkuk University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant His-tagged aurora B expressed in baculovirus infected Sf21 insect cells by Western blot analysis

Bioorg Med Chem Lett 26: 4301-9 (2016)


Article DOI: 10.1016/j.bmcl.2016.07.037
BindingDB Entry DOI: 10.7270/Q2DF6VQV
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))		BDBM153267
PNG
(5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-7-[(2S,3R,...)
Show SMILES COc1ccc(cc1O)-c1cc(=O)c2c(O)cc(O[C@@H]3O[C@H](CO[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)cc2o1
Show InChI InChI=1S/C28H32O15/c1-10-21(32)23(34)25(36)27(40-10)39-9-19-22(33)24(35)26(37)28(43-19)41-12-6-14(30)20-15(31)8-17(42-18(20)7-12)11-3-4-16(38-2)13(29)5-11/h3-8,10,19,21-30,32-37H,9H2,1-2H3/t10-,19+,21-,22+,23+,24-,25+,26+,27+,28+/m0/s1
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n/an/a 9.14E+3n/an/an/an/an/an/a



Konkuk University



Assay Description
The kinase assay was performed using the EMD Millipore KinaseProfiler service assay protocol. Aurora B kinase was supplied by EMD Millipore Corp. The...

Chem Biol Drug Des 85: 574-85 (2015)


Article DOI: 10.1111/cbdd.12445
BindingDB Entry DOI: 10.7270/Q2M61J08
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))		BDBM50049391
PNG
(3,5,7-Trihydroxyflavone | 3,5,7-triOH-flavone | 3,...)
Show SMILES Oc1cc(O)c2c(c1)oc(-c1ccccc1)c(O)c2=O
Show InChI InChI=1S/C15H10O5/c16-9-6-10(17)12-11(7-9)20-15(14(19)13(12)18)8-4-2-1-3-5-8/h1-7,16-17,19H
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n/an/a 9.80E+3n/an/an/an/an/an/a



Konkuk University



Assay Description
The kinase assay was performed using the EMD Millipore KinaseProfiler service assay protocol. Aurora B kinase was supplied by EMD Millipore Corp. The...

Chem Biol Drug Des 85: 574-85 (2015)


Article DOI: 10.1111/cbdd.12445
BindingDB Entry DOI: 10.7270/Q2M61J08
More data for this
Ligand-Target Pair
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