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Compile Data Set for Download or QSAR

Marvin 2D Structure

Wt: 350.4
BDBM50320916
Wt: 362.4
BDBM50320924
Wt: 362.4
BDBM50320925
Wt: 334.4
BDBM50320926
Wt: 362.4
BDBM50320928
Wt: 363.4
BDBM50321933
Wt: 331.4
BDBM50321936
Wt: 345.4
BDBM50321937
Wt: 359.4
BDBM50321940
Wt: 359.4
BDBM50391545
Wt: 345.4
BDBM50391557
Wt: 352.4
BDBM50424123
Wt: 324.3
BDBM50424135
Wt: 364.3
BDBM50424146
Wt: 322.3
BDBM50424147
Displayed 1 to 15 (of 113 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 18 hits in this display   
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
Interleukin-5


(Mus musculus)
BDBM50320916
PNG
(5-(cyclohexylmethoxy)-3-(4-hydroxyphenyl)-4H-chrom...)
Show SMILES Oc1ccc(cc1)-c1coc2cccc(OCC3CCCCC3)c2c1=O
Show InChI InChI=1S/C22H22O4/c23-17-11-9-16(10-12-17)18-14-26-20-8-4-7-19(21(20)22(18)24)25-13-15-5-2-1-3-6-15/h4,7-12,14-15,23H,1-3,5-6,13H2
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n/an/a 5.80E+3n/an/an/an/an/an/a



Chungnam National University

Curated by ChEMBL


Assay Description
Inhibition of IL-5 in mouse pro-B Y16 cells after 48 hrs by WST1 assay


Eur J Med Chem 59: 31-8 (2013)


Article DOI: 10.1016/j.ejmech.2012.11.007
BindingDB Entry DOI: 10.7270/Q2PV6MP4
More data for this
Ligand-Target Pair
Interleukin-5


(Mus musculus)
BDBM50320916
PNG
(5-(cyclohexylmethoxy)-3-(4-hydroxyphenyl)-4H-chrom...)
Show SMILES Oc1ccc(cc1)-c1coc2cccc(OCC3CCCCC3)c2c1=O
Show InChI InChI=1S/C22H22O4/c23-17-11-9-16(10-12-17)18-14-26-20-8-4-7-19(21(20)22(18)24)25-13-15-5-2-1-3-6-15/h4,7-12,14-15,23H,1-3,5-6,13H2
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n/an/a 5.80E+3n/an/an/an/an/an/a



Chungnam National University

Curated by ChEMBL


Assay Description
Inhibition interleukin-5 in mouse Y16 cells after 48 hrs by WST-1 assay


Bioorg Med Chem 21: 2543-50 (2013)


Article DOI: 10.1016/j.bmc.2013.02.037
BindingDB Entry DOI: 10.7270/Q2RR20MV
More data for this
Ligand-Target Pair
Interleukin-5


(Mus musculus)
BDBM50320916
PNG
(5-(cyclohexylmethoxy)-3-(4-hydroxyphenyl)-4H-chrom...)
Show SMILES Oc1ccc(cc1)-c1coc2cccc(OCC3CCCCC3)c2c1=O
Show InChI InChI=1S/C22H22O4/c23-17-11-9-16(10-12-17)18-14-26-20-8-4-7-19(21(20)22(18)24)25-13-15-5-2-1-3-6-15/h4,7-12,14-15,23H,1-3,5-6,13H2
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n/an/a 5.80E+3n/an/an/an/an/an/a



Chungnam National University

Curated by ChEMBL


Assay Description
Inhibition of IL5-mediated proliferation of mouse Y16 cells by WST1 assay


Bioorg Med Chem 18: 4441-5 (2010)


Article DOI: 10.1016/j.bmc.2010.04.075
BindingDB Entry DOI: 10.7270/Q2H41SDX
More data for this
Ligand-Target Pair
Interleukin-5


(Mus musculus)
BDBM50424123
PNG
(CHEMBL2316358)
Show SMILES Oc1ccc(cc1)C(=O)\C=C\c1c(O)cccc1OCC1CCCCC1
Show InChI InChI=1S/C22H24O4/c23-18-11-9-17(10-12-18)20(24)14-13-19-21(25)7-4-8-22(19)26-15-16-5-2-1-3-6-16/h4,7-14,16,23,25H,1-3,5-6,15H2/b14-13+
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n/an/a 1.26E+4n/an/an/an/an/an/a



Chungnam National University

Curated by ChEMBL


Assay Description
Inhibition of mouse IL5-mediated mouse Y16 cell proliferation after 48 hrs by WST1 assay


Bioorg Med Chem 23: 2498-504 (2015)


Article DOI: 10.1016/j.bmc.2015.03.045
BindingDB Entry DOI: 10.7270/Q25D8TJF
More data for this
Ligand-Target Pair
Interleukin-5


(Mus musculus)
BDBM50424123
PNG
(CHEMBL2316358)
Show SMILES Oc1ccc(cc1)C(=O)\C=C\c1c(O)cccc1OCC1CCCCC1
Show InChI InChI=1S/C22H24O4/c23-18-11-9-17(10-12-18)20(24)14-13-19-21(25)7-4-8-22(19)26-15-16-5-2-1-3-6-16/h4,7-14,16,23,25H,1-3,5-6,15H2/b14-13+
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n/an/a 1.26E+4n/an/an/an/an/an/a



Chungnam National University

Curated by ChEMBL


Assay Description
Inhibition of IL-5 in mouse pro-B Y16 cells after 48 hrs by WST1 assay


Eur J Med Chem 59: 31-8 (2013)


Article DOI: 10.1016/j.ejmech.2012.11.007
BindingDB Entry DOI: 10.7270/Q2PV6MP4
More data for this
Ligand-Target Pair
Interleukin-5


(Mus musculus)
BDBM50424146
PNG
(CHEMBL2316360)
Show SMILES CC(C)COc1cccc2occ(\C=C\C(=O)c3ccc(O)cc3)c(=O)c12
Show InChI InChI=1S/C22H20O5/c1-14(2)12-26-19-4-3-5-20-21(19)22(25)16(13-27-20)8-11-18(24)15-6-9-17(23)10-7-15/h3-11,13-14,23H,12H2,1-2H3/b11-8+
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n/an/a 1.91E+4n/an/an/an/an/an/a



Chungnam National University

Curated by ChEMBL


Assay Description
Inhibition of IL-5 in mouse pro-B Y16 cells after 48 hrs by WST1 assay


Eur J Med Chem 59: 31-8 (2013)


Article DOI: 10.1016/j.ejmech.2012.11.007
BindingDB Entry DOI: 10.7270/Q2PV6MP4
More data for this
Ligand-Target Pair
Interleukin-5


(Mus musculus)
BDBM50391545
PNG
(CHEMBL2147490)
Show SMILES CCN(CCO)Cc1coc2cccc(OCC3CCCCC3)c2c1=O
Show InChI InChI=1S/C21H29NO4/c1-2-22(11-12-23)13-17-15-26-19-10-6-9-18(20(19)21(17)24)25-14-16-7-4-3-5-8-16/h6,9-10,15-16,23H,2-5,7-8,11-14H2,1H3
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n/an/a 1.95E+4n/an/an/an/an/an/a



Chungnam National University

Curated by ChEMBL


Assay Description
Inhibition of IL-5 in mouse Y16 cells after 48 hrs by WST1 assay


Bioorg Med Chem 20: 5757-62 (2012)


Article DOI: 10.1016/j.bmc.2012.08.006
BindingDB Entry DOI: 10.7270/Q2PG1SSV
More data for this
Ligand-Target Pair
Interleukin-5


(Mus musculus)
BDBM50321940
PNG
(5-(Cyclohexylmethoxy)-3-((1-hydroxy-2-methylpropan...)
Show SMILES CC(C)(CO)NCc1coc2cccc(OCC3CCCCC3)c2c1=O
Show InChI InChI=1S/C21H29NO4/c1-21(2,14-23)22-11-16-13-26-18-10-6-9-17(19(18)20(16)24)25-12-15-7-4-3-5-8-15/h6,9-10,13,15,22-23H,3-5,7-8,11-12,14H2,1-2H3
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n/an/a 2.64E+4n/an/an/an/an/an/a



Chungnam National University

Curated by ChEMBL


Assay Description
Inhibition of interleukin-5 in mouse Y16 cells


Bioorg Med Chem 18: 4625-9 (2011)


Article DOI: 10.1016/j.bmc.2010.05.028
BindingDB Entry DOI: 10.7270/Q2B8593F
More data for this
Ligand-Target Pair
Interleukin-5


(Mus musculus)
BDBM50320928
PNG
((Z)-4-{[4-(Cyclohexylmethoxy)-3-oxobenzofuran-2(3H...)
Show SMILES O=Cc1ccc(\C=C2/Oc3cccc(OCC4CCCCC4)c3C2=O)cc1
Show InChI InChI=1S/C23H22O4/c24-14-17-11-9-16(10-12-17)13-21-23(25)22-19(7-4-8-20(22)27-21)26-15-18-5-2-1-3-6-18/h4,7-14,18H,1-3,5-6,15H2/b21-13-
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n/an/a>3.00E+4n/an/an/an/an/an/a



Chungnam National University

Curated by ChEMBL


Assay Description
Inhibition of IL5-mediated proliferation of mouse Y16 cells by WST1 assay


Bioorg Med Chem 18: 4441-5 (2010)


Article DOI: 10.1016/j.bmc.2010.04.075
BindingDB Entry DOI: 10.7270/Q2H41SDX
More data for this
Ligand-Target Pair
Interleukin-5


(Mus musculus)
BDBM50320926
PNG
((Z)-2-(Benzylidene)-4-(cyclohexylmethoxy)benzofura...)
Show SMILES O=C1\C(Oc2cccc(OCC3CCCCC3)c12)=C\c1ccccc1
Show InChI InChI=1S/C22H22O3/c23-22-20(14-16-8-3-1-4-9-16)25-19-13-7-12-18(21(19)22)24-15-17-10-5-2-6-11-17/h1,3-4,7-9,12-14,17H,2,5-6,10-11,15H2/b20-14-
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n/an/a>3.00E+4n/an/an/an/an/an/a



Chungnam National University

Curated by ChEMBL


Assay Description
Inhibition of IL5-mediated proliferation of mouse Y16 cells by WST1 assay


Bioorg Med Chem 18: 4441-5 (2010)


Article DOI: 10.1016/j.bmc.2010.04.075
BindingDB Entry DOI: 10.7270/Q2H41SDX
More data for this
Ligand-Target Pair
Interleukin-5


(Mus musculus)
BDBM50320925
PNG
((Z)-4-(cyclohexylmethoxy)-2-(4-ethylbenzylidene)be...)
Show SMILES CCc1ccc(\C=C2/Oc3cccc(OCC4CCCCC4)c3C2=O)cc1
Show InChI InChI=1S/C24H26O3/c1-2-17-11-13-18(14-12-17)15-22-24(25)23-20(9-6-10-21(23)27-22)26-16-19-7-4-3-5-8-19/h6,9-15,19H,2-5,7-8,16H2,1H3/b22-15-
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n/an/a>3.00E+4n/an/an/an/an/an/a



Chungnam National University

Curated by ChEMBL


Assay Description
Inhibition of IL5-mediated proliferation of mouse Y16 cells by WST1 assay


Bioorg Med Chem 18: 4441-5 (2010)


Article DOI: 10.1016/j.bmc.2010.04.075
BindingDB Entry DOI: 10.7270/Q2H41SDX
More data for this
Ligand-Target Pair
Interleukin-5


(Mus musculus)
BDBM50424147
PNG
(CHEMBL2316359)
Show SMILES COc1cccc2occ(\C=C\C(=O)c3ccc(O)cc3)c(=O)c12
Show InChI InChI=1S/C19H14O5/c1-23-16-3-2-4-17-18(16)19(22)13(11-24-17)7-10-15(21)12-5-8-14(20)9-6-12/h2-11,20H,1H3/b10-7+
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n/an/a>3.00E+4n/an/an/an/an/an/a



Chungnam National University

Curated by ChEMBL


Assay Description
Inhibition of IL-5 in mouse pro-B Y16 cells after 48 hrs by WST1 assay


Eur J Med Chem 59: 31-8 (2013)


Article DOI: 10.1016/j.ejmech.2012.11.007
BindingDB Entry DOI: 10.7270/Q2PV6MP4
More data for this
Ligand-Target Pair
Interleukin-5


(Mus musculus)
BDBM50424135
PNG
(CHEMBL2316371)
Show SMILES COc1cccc2occ(\C=C\C(O)c3ccc(O)cc3)c(=O)c12
Show InChI InChI=1S/C19H16O5/c1-23-16-3-2-4-17-18(16)19(22)13(11-24-17)7-10-15(21)12-5-8-14(20)9-6-12/h2-11,15,20-21H,1H3/b10-7+
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n/an/a>3.00E+4n/an/an/an/an/an/a



Chungnam National University

Curated by ChEMBL


Assay Description
Inhibition of IL-5 in mouse pro-B Y16 cells after 48 hrs by WST1 assay


Eur J Med Chem 59: 31-8 (2013)


Article DOI: 10.1016/j.ejmech.2012.11.007
BindingDB Entry DOI: 10.7270/Q2PV6MP4
More data for this
Ligand-Target Pair
Interleukin-5


(Mus musculus)
BDBM50320924
PNG
(5-(Cyclohexylmethoxy)-3-(4-ethylphenyl)-4H-chromen...)
Show SMILES CCc1ccc(cc1)-c1coc2cccc(OCC3CCCCC3)c2c1=O
Show InChI InChI=1S/C24H26O3/c1-2-17-11-13-19(14-12-17)20-16-27-22-10-6-9-21(23(22)24(20)25)26-15-18-7-4-3-5-8-18/h6,9-14,16,18H,2-5,7-8,15H2,1H3
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n/an/a>3.00E+4n/an/an/an/an/an/a



Chungnam National University

Curated by ChEMBL


Assay Description
Inhibition of IL5-mediated proliferation of mouse Y16 cells by WST1 assay


Bioorg Med Chem 18: 4441-5 (2010)


Article DOI: 10.1016/j.bmc.2010.04.075
BindingDB Entry DOI: 10.7270/Q2H41SDX
More data for this
Ligand-Target Pair
Interleukin-5


(Mus musculus)
BDBM50391557
PNG
(CHEMBL2147489)
Show SMILES CN(CCO)Cc1coc2cccc(OCC3CCCCC3)c2c1=O
Show InChI InChI=1S/C20H27NO4/c1-21(10-11-22)12-16-14-25-18-9-5-8-17(19(18)20(16)23)24-13-15-6-3-2-4-7-15/h5,8-9,14-15,22H,2-4,6-7,10-13H2,1H3
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n/an/a 3.03E+4n/an/an/an/an/an/a



Chungnam National University

Curated by ChEMBL


Assay Description
Inhibition of IL-5 in mouse Y16 cells after 48 hrs by WST1 assay


Bioorg Med Chem 20: 5757-62 (2012)


Article DOI: 10.1016/j.bmc.2012.08.006
BindingDB Entry DOI: 10.7270/Q2PG1SSV
More data for this
Ligand-Target Pair
Interleukin-5


(Mus musculus)
BDBM50321933
PNG
(5-(Cyclohexylmethoxy)-3-((phenylamino)methyl)-4Hch...)
Show SMILES O=c1c(CNc2ccccc2)coc2cccc(OCC3CCCCC3)c12
Show InChI InChI=1S/C23H25NO3/c25-23-18(14-24-19-10-5-2-6-11-19)16-27-21-13-7-12-20(22(21)23)26-15-17-8-3-1-4-9-17/h2,5-7,10-13,16-17,24H,1,3-4,8-9,14-15H2
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n/an/a>5.00E+4n/an/an/an/an/an/a



Chungnam National University

Curated by ChEMBL


Assay Description
Inhibition of interleukin-5 in mouse Y16 cells


Bioorg Med Chem 18: 4625-9 (2011)


Article DOI: 10.1016/j.bmc.2010.05.028
BindingDB Entry DOI: 10.7270/Q2B8593F
More data for this
Ligand-Target Pair
Interleukin-5


(Mus musculus)
BDBM50321936
PNG
(5-(Cyclohexylmethoxy)-3-((2-hydroxyethylamino)-met...)
Show SMILES OCCNCc1coc2cccc(OCC3CCCCC3)c2c1=O
Show InChI InChI=1S/C19H25NO4/c21-10-9-20-11-15-13-24-17-8-4-7-16(18(17)19(15)22)23-12-14-5-2-1-3-6-14/h4,7-8,13-14,20-21H,1-3,5-6,9-12H2
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n/an/a>5.00E+4n/an/an/an/an/an/a



Chungnam National University

Curated by ChEMBL


Assay Description
Inhibition of interleukin-5 in mouse Y16 cells


Bioorg Med Chem 18: 4625-9 (2011)


Article DOI: 10.1016/j.bmc.2010.05.028
BindingDB Entry DOI: 10.7270/Q2B8593F
More data for this
Ligand-Target Pair
Interleukin-5


(Mus musculus)
BDBM50321937
PNG
(5-(Cyclohexylmethoxy)-3-((3-hydroxypropylamino)-me...)
Show SMILES OCCCNCc1coc2cccc(OCC3CCCCC3)c2c1=O
Show InChI InChI=1S/C20H27NO4/c22-11-5-10-21-12-16-14-25-18-9-4-8-17(19(18)20(16)23)24-13-15-6-2-1-3-7-15/h4,8-9,14-15,21-22H,1-3,5-7,10-13H2
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n/an/a>5.00E+4n/an/an/an/an/an/a



Chungnam National University

Curated by ChEMBL


Assay Description
Inhibition of interleukin-5 in mouse Y16 cells


Bioorg Med Chem 18: 4625-9 (2011)


Article DOI: 10.1016/j.bmc.2010.05.028
BindingDB Entry DOI: 10.7270/Q2B8593F
More data for this
Ligand-Target Pair