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Compile Data Set for Download or QSAR

Found 48 hits with Last Name = 'hannan' and Initial = 'gn'   
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
Ecdysone receptor/Protein ultraspiracle homolog


(Choristoneura fumiferana)
BDBM50178988
PNG
(CHEBI:38452 | Tebufenozide)
Show SMILES CCc1ccc(cc1)C(=O)NN(C(=O)c1cc(C)cc(C)c1)C(C)(C)C
Show InChI InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)
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0.501n/an/an/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Binding affinity to Choristoneura fumiferana EcR


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ecdysone receptor/Ultraspiracle


(Chilo suppressalis)
BDBM50178988
PNG
(CHEBI:38452 | Tebufenozide)
Show SMILES CCc1ccc(cc1)C(=O)NN(C(=O)c1cc(C)cc(C)c1)C(C)(C)C
Show InChI InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)
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1.30n/an/an/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Binding affinity to Chilo suppressalis (rice stem borer) EcR


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ecdysone receptor/Gene regulation protein


(Heliothis virescens)
BDBM50178988
PNG
(CHEBI:38452 | Tebufenozide)
Show SMILES CCc1ccc(cc1)C(=O)NN(C(=O)c1cc(C)cc(C)c1)C(C)(C)C
Show InChI InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)
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3.20n/an/an/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Binding affinity to Heliothis virescens (tobacco budworm) EcR


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ecdysone receptor/USP


(Plodia interpunctella)
BDBM50178988
PNG
(CHEBI:38452 | Tebufenozide)
Show SMILES CCc1ccc(cc1)C(=O)NN(C(=O)c1cc(C)cc(C)c1)C(C)(C)C
Show InChI InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)
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3.20n/an/an/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Binding affinity to Plodia interpunctella (Indian meal moth ) EcR


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ecdysone receptor/Ultraspiracle


(Chironomus tentans)
BDBM50178988
PNG
(CHEBI:38452 | Tebufenozide)
Show SMILES CCc1ccc(cc1)C(=O)NN(C(=O)c1cc(C)cc(C)c1)C(C)(C)C
Show InChI InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)
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10n/an/an/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Binding affinity to Chironomus tentans EcR


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle isoform-A


(Aedes aegypti)
BDBM50178988
PNG
(CHEBI:38452 | Tebufenozide)
Show SMILES CCc1ccc(cc1)C(=O)NN(C(=O)c1cc(C)cc(C)c1)C(C)(C)C
Show InChI InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)
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25n/an/an/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Binding affinity to Aedes aegypti EcR


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle


(Nezara viridula)
BDBM50488539
PNG
(Muristerone A)
Show SMILES [H][C@@]1(CC[C@@]2(O)C3=CC(=O)[C@]4(O)C[C@@H](O)[C@@H](O)C[C@]4(C)[C@@]3([H])[C@H](O)C[C@]12C)[C@@](C)(O)[C@H](O)CCC(C)C |r,t:6|
Show InChI InChI=1S/C27H44O8/c1-14(2)6-7-20(31)25(5,33)19-8-9-26(34)15-10-21(32)27(35)13-17(29)16(28)11-24(27,4)22(15)18(30)12-23(19,26)3/h10,14,16-20,22,28-31,33-35H,6-9,11-13H2,1-5H3/t16-,17+,18+,19-,20+,22+,23+,24+,25+,26+,27+/m0/s1
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100n/an/an/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]PonA from recombinant Nezara viridula EcR10


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle


(Nezara viridula)
BDBM50488539
PNG
(Muristerone A)
Show SMILES [H][C@@]1(CC[C@@]2(O)C3=CC(=O)[C@]4(O)C[C@@H](O)[C@@H](O)C[C@]4(C)[C@@]3([H])[C@H](O)C[C@]12C)[C@@](C)(O)[C@H](O)CCC(C)C |r,t:6|
Show InChI InChI=1S/C27H44O8/c1-14(2)6-7-20(31)25(5,33)19-8-9-26(34)15-10-21(32)27(35)13-17(29)16(28)11-24(27,4)22(15)18(30)12-23(19,26)3/h10,14,16-20,22,28-31,33-35H,6-9,11-13H2,1-5H3/t16-,17+,18+,19-,20+,22+,23+,24+,25+,26+,27+/m0/s1
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100n/an/an/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]PonA from recombinant Nezara viridula EcR11


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ecdysone receptor/Ultraspiracle protein


(Lucilia cuprina)
BDBM50178988
PNG
(CHEBI:38452 | Tebufenozide)
Show SMILES CCc1ccc(cc1)C(=O)NN(C(=O)c1cc(C)cc(C)c1)C(C)(C)C
Show InChI InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)
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158n/an/an/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Binding affinity to Lucilia cuprina EcR


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle


(Nezara viridula)
BDBM50326776
PNG
(2,3,14,20,22-PENTAHYDROXYCHOLEST-7-EN-6-ONE | CHEM...)
Show SMILES CC(C)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C |r,t:15|
Show InChI InChI=1S/C27H44O6/c1-15(2)6-7-23(31)26(5,32)22-9-11-27(33)17-12-19(28)18-13-20(29)21(30)14-24(18,3)16(17)8-10-25(22,27)4/h12,15-16,18,20-23,29-33H,6-11,13-14H2,1-5H3/t16-,18-,20+,21-,22-,23+,24+,25+,26+,27+/m0/s1
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200n/an/an/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]PonA from recombinant Nezara viridula EcR11


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle


(Nezara viridula)
BDBM50326776
PNG
(2,3,14,20,22-PENTAHYDROXYCHOLEST-7-EN-6-ONE | CHEM...)
Show SMILES CC(C)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C |r,t:15|
Show InChI InChI=1S/C27H44O6/c1-15(2)6-7-23(31)26(5,32)22-9-11-27(33)17-12-19(28)18-13-20(29)21(30)14-24(18,3)16(17)8-10-25(22,27)4/h12,15-16,18,20-23,29-33H,6-11,13-14H2,1-5H3/t16-,18-,20+,21-,22-,23+,24+,25+,26+,27+/m0/s1
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200n/an/an/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]PonA from recombinant Nezara viridula EcR10


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Protein ultraspiracle


(Drosophila melanogaster)
BDBM50178988
PNG
(CHEBI:38452 | Tebufenozide)
Show SMILES CCc1ccc(cc1)C(=O)NN(C(=O)c1cc(C)cc(C)c1)C(C)(C)C
Show InChI InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)
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251n/an/an/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Binding affinity to Drosophila melanogaster EcR


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle


(Nezara viridula)
BDBM50326777
PNG
((2beta,3beta,5beta,22R)-2,3,14,20,22,25-hexahydrox...)
Show SMILES CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C |r,t:16|
Show InChI InChI=1S/C27H44O7/c1-23(2,32)9-8-22(31)26(5,33)21-7-11-27(34)16-12-18(28)17-13-19(29)20(30)14-24(17,3)15(16)6-10-25(21,27)4/h12,15,17,19-22,29-34H,6-11,13-14H2,1-5H3/t15-,17-,19+,20-,21-,22+,24+,25+,26+,27+/m0/s1
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2.50E+3n/an/an/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]PonA from recombinant Nezara viridula EcR10


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle isoform B


(Leptinotarsa decemlineata)
BDBM50178988
PNG
(CHEBI:38452 | Tebufenozide)
Show SMILES CCc1ccc(cc1)C(=O)NN(C(=O)c1cc(C)cc(C)c1)C(C)(C)C
Show InChI InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)
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2.51E+3n/an/an/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Binding affinity to Leptinotarsa decemlineata EcR


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle


(Nezara viridula)
BDBM50326777
PNG
((2beta,3beta,5beta,22R)-2,3,14,20,22,25-hexahydrox...)
Show SMILES CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C |r,t:16|
Show InChI InChI=1S/C27H44O7/c1-23(2,32)9-8-22(31)26(5,33)21-7-11-27(34)16-12-18(28)17-13-19(29)20(30)14-24(17,3)15(16)6-10-25(21,27)4/h12,15,17,19-22,29-34H,6-11,13-14H2,1-5H3/t15-,17-,19+,20-,21-,22+,24+,25+,26+,27+/m0/s1
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3.00E+3n/an/an/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]PonA from recombinant Nezara viridula EcR11


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle


(Nezara viridula)
BDBM50414646
PNG
(INOKOSTERONE)
Show SMILES C[C@H](CO)CC[C@H](O)[C@@](C)(O)[C@@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@H](O)[C@@H](O)C[C@@]4(C)[C@H]3CC[C@@]12C |r,t:16|
Show InChI InChI=1S/C27H44O7/c1-15(14-28)5-6-23(32)26(4,33)22-8-10-27(34)17-11-19(29)18-12-20(30)21(31)13-24(18,2)16(17)7-9-25(22,27)3/h11,15-16,18,20-23,28,30-34H,5-10,12-14H2,1-4H3/t15-,16-,18-,20-,21-,22+,23-,24-,25-,26-,27+/m0/s1
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6.00E+3n/an/an/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]PonA from recombinant Nezara viridula EcR11


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle


(Nezara viridula)
BDBM50414646
PNG
(INOKOSTERONE)
Show SMILES C[C@H](CO)CC[C@H](O)[C@@](C)(O)[C@@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@H](O)[C@@H](O)C[C@@]4(C)[C@H]3CC[C@@]12C |r,t:16|
Show InChI InChI=1S/C27H44O7/c1-15(14-28)5-6-23(32)26(4,33)22-8-10-27(34)17-11-19(29)18-12-20(30)21(31)13-24(18,2)16(17)7-9-25(22,27)3/h11,15-16,18,20-23,28,30-34H,5-10,12-14H2,1-4H3/t15-,16-,18-,20-,21-,22+,23-,24-,25-,26-,27+/m0/s1
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6.70E+3n/an/an/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]PonA from recombinant Nezara viridula EcR10


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ecdysone receptor/Ultraspiracle


(Anthonomus grandis-Leptinotarsa decemlineata)
BDBM50178988
PNG
(CHEBI:38452 | Tebufenozide)
Show SMILES CCc1ccc(cc1)C(=O)NN(C(=O)c1cc(C)cc(C)c1)C(C)(C)C
Show InChI InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)
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1.26E+4n/an/an/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Binding affinity to Anthonomus grandis ecdysone receptor (EcR)


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle


(Nezara viridula)
BDBM50178988
PNG
(CHEBI:38452 | Tebufenozide)
Show SMILES CCc1ccc(cc1)C(=O)NN(C(=O)c1cc(C)cc(C)c1)C(C)(C)C
Show InChI InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)
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1.68E+4n/an/an/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]PonA from recombinant Nezara viridula EcR10


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle


(Nezara viridula)
BDBM50178988
PNG
(CHEBI:38452 | Tebufenozide)
Show SMILES CCc1ccc(cc1)C(=O)NN(C(=O)c1cc(C)cc(C)c1)C(C)(C)C
Show InChI InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)
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2.00E+4n/an/an/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Binding affinity to Nezara viridula EcR10


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle


(Nezara viridula)
BDBM50178988
PNG
(CHEBI:38452 | Tebufenozide)
Show SMILES CCc1ccc(cc1)C(=O)NN(C(=O)c1cc(C)cc(C)c1)C(C)(C)C
Show InChI InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)
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2.39E+4n/an/an/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]PonA from recombinant Nezara viridula EcR11


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle


(Nezara viridula)
BDBM50178988
PNG
(CHEBI:38452 | Tebufenozide)
Show SMILES CCc1ccc(cc1)C(=O)NN(C(=O)c1cc(C)cc(C)c1)C(C)(C)C
Show InChI InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)
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2.51E+4n/an/an/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Binding affinity to Nezara viridula EcR


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle


(Nezara viridula)
BDBM50178988
PNG
(CHEBI:38452 | Tebufenozide)
Show SMILES CCc1ccc(cc1)C(=O)NN(C(=O)c1cc(C)cc(C)c1)C(C)(C)C
Show InChI InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)
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2.51E+4n/an/an/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Binding affinity to Nezara viridula EcR11


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle


(Nezara viridula)
BDBM50414651
PNG
(ECDYSONE)
Show SMILES C[C@H]([C@@H](O)CCC(C)(C)O)[C@@H]1CC[C@]2(O)C3=CC(=O)[C@@H]4C[C@H](O)[C@@H](O)C[C@@]4(C)[C@@H]3CC[C@@]12C |r,t:15,@@:6|
Show InChI InChI=1S/C27H44O6/c1-15(20(28)8-9-24(2,3)32)16-7-11-27(33)18-12-21(29)19-13-22(30)23(31)14-25(19,4)17(18)6-10-26(16,27)5/h12,15-17,19-20,22-23,28,30-33H,6-11,13-14H2,1-5H3/t15-,16-,17+,19-,20-,22-,23-,25-,26-,27-/m0/s1
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5.04E+4n/an/an/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]PonA from recombinant Nezara viridula EcR10


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle


(Nezara viridula)
BDBM50414651
PNG
(ECDYSONE)
Show SMILES C[C@H]([C@@H](O)CCC(C)(C)O)[C@@H]1CC[C@]2(O)C3=CC(=O)[C@@H]4C[C@H](O)[C@@H](O)C[C@@]4(C)[C@@H]3CC[C@@]12C |r,t:15,@@:6|
Show InChI InChI=1S/C27H44O6/c1-15(20(28)8-9-24(2,3)32)16-7-11-27(33)18-12-21(29)19-13-22(30)23(31)14-25(19,4)17(18)6-10-26(16,27)5/h12,15-17,19-20,22-23,28,30-33H,6-11,13-14H2,1-5H3/t15-,16-,17+,19-,20-,22-,23-,25-,26-,27-/m0/s1
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5.11E+4n/an/an/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]PonA from recombinant Nezara viridula EcR11


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ecdysone receptor/Nuclear receptor RXR-l


(Locusta migratoria)
BDBM50178988
PNG
(CHEBI:38452 | Tebufenozide)
Show SMILES CCc1ccc(cc1)C(=O)NN(C(=O)c1cc(C)cc(C)c1)C(C)(C)C
Show InChI InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)
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1.00E+5n/an/an/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Binding affinity to Locusta migratoria ecdysone receptor (EcR)


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ecdysone receptor/Ultraspiracle protein


(Myzus persicae)
BDBM50178988
PNG
(CHEBI:38452 | Tebufenozide)
Show SMILES CCc1ccc(cc1)C(=O)NN(C(=O)c1cc(C)cc(C)c1)C(C)(C)C
Show InChI InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)
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<1.26E+5n/an/an/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Binding affinity to Myzus persicae EcR (green peach aphid)


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ecdysone receptor/Ultraspiracle protein


(Bemisia tabaci)
BDBM50178988
PNG
(CHEBI:38452 | Tebufenozide)
Show SMILES CCc1ccc(cc1)C(=O)NN(C(=O)c1cc(C)cc(C)c1)C(C)(C)C
Show InChI InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)
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<5.01E+5n/an/an/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Binding affinity to Bemisia tabaci (sweet potato whitefly) ecdysone receptor (EcR)


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Protein ultraspiracle


(Drosophila melanogaster)
BDBM50326777
PNG
((2beta,3beta,5beta,22R)-2,3,14,20,22,25-hexahydrox...)
Show SMILES CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C |r,t:16|
Show InChI InChI=1S/C27H44O7/c1-23(2,32)9-8-22(31)26(5,33)21-7-11-27(34)16-12-18(28)17-13-19(29)20(30)14-24(17,3)15(16)6-10-25(21,27)4/h12,15,17,19-22,29-34H,6-11,13-14H2,1-5H3/t15-,17-,19+,20-,21-,22+,24+,25+,26+,27+/m0/s1
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n/an/a 46n/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Binding affinity to Drosophila melanogaster EcR


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle


(Nezara viridula)
BDBM50488539
PNG
(Muristerone A)
Show SMILES [H][C@@]1(CC[C@@]2(O)C3=CC(=O)[C@]4(O)C[C@@H](O)[C@@H](O)C[C@]4(C)[C@@]3([H])[C@H](O)C[C@]12C)[C@@](C)(O)[C@H](O)CCC(C)C |r,t:6|
Show InChI InChI=1S/C27H44O8/c1-14(2)6-7-20(31)25(5,33)19-8-9-26(34)15-10-21(32)27(35)13-17(29)16(28)11-24(27,4)22(15)18(30)12-23(19,26)3/h10,14,16-20,22,28-31,33-35H,6-9,11-13H2,1-5H3/t16-,17+,18+,19-,20+,22+,23+,24+,25+,26+,27+/m0/s1
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n/an/a 130n/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]PonA from recombinant Nezara viridula EcR10


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle


(Nezara viridula)
BDBM50488539
PNG
(Muristerone A)
Show SMILES [H][C@@]1(CC[C@@]2(O)C3=CC(=O)[C@]4(O)C[C@@H](O)[C@@H](O)C[C@]4(C)[C@@]3([H])[C@H](O)C[C@]12C)[C@@](C)(O)[C@H](O)CCC(C)C |r,t:6|
Show InChI InChI=1S/C27H44O8/c1-14(2)6-7-20(31)25(5,33)19-8-9-26(34)15-10-21(32)27(35)13-17(29)16(28)11-24(27,4)22(15)18(30)12-23(19,26)3/h10,14,16-20,22,28-31,33-35H,6-9,11-13H2,1-5H3/t16-,17+,18+,19-,20+,22+,23+,24+,25+,26+,27+/m0/s1
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n/an/a 150n/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]PonA from recombinant Nezara viridula EcR11


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle protein


(Spodoptera frugiperda)
BDBM50326777
PNG
((2beta,3beta,5beta,22R)-2,3,14,20,22,25-hexahydrox...)
Show SMILES CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C |r,t:16|
Show InChI InChI=1S/C27H44O7/c1-23(2,32)9-8-22(31)26(5,33)21-7-11-27(34)16-12-18(28)17-13-19(29)20(30)14-24(17,3)15(16)6-10-25(21,27)4/h12,15,17,19-22,29-34H,6-11,13-14H2,1-5H3/t15-,17-,19+,20-,21-,22+,24+,25+,26+,27+/m0/s1
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n/an/a 166n/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Binding affinity to Spodoptera frugiperda (fall armyworm) EcR


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle


(Nezara viridula)
BDBM50326776
PNG
(2,3,14,20,22-PENTAHYDROXYCHOLEST-7-EN-6-ONE | CHEM...)
Show SMILES CC(C)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C |r,t:15|
Show InChI InChI=1S/C27H44O6/c1-15(2)6-7-23(31)26(5,32)22-9-11-27(33)17-12-19(28)18-13-20(29)21(30)14-24(18,3)16(17)8-10-25(22,27)4/h12,15-16,18,20-23,29-33H,6-11,13-14H2,1-5H3/t16-,18-,20+,21-,22-,23+,24+,25+,26+,27+/m0/s1
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n/an/a 250n/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]PonA from recombinant Nezara viridula EcR11


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle


(Nezara viridula)
BDBM50326776
PNG
(2,3,14,20,22-PENTAHYDROXYCHOLEST-7-EN-6-ONE | CHEM...)
Show SMILES CC(C)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C |r,t:15|
Show InChI InChI=1S/C27H44O6/c1-15(2)6-7-23(31)26(5,32)22-9-11-27(33)17-12-19(28)18-13-20(29)21(30)14-24(18,3)16(17)8-10-25(22,27)4/h12,15-16,18,20-23,29-33H,6-11,13-14H2,1-5H3/t16-,18-,20+,21-,22-,23+,24+,25+,26+,27+/m0/s1
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n/an/a 280n/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]PonA from recombinant Nezara viridula EcR10


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ecdysone receptor/Ultraspiracle protein


(Spodoptera frugiperda)
BDBM50226672
PNG
(CHEMBL255034 | makisterone A)
Show SMILES C[C@H](C[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C)C(C)(C)O |t:13|
Show InChI InChI=1S/C28H46O7/c1-15(24(2,3)33)11-23(32)27(6,34)22-8-10-28(35)17-12-19(29)18-13-20(30)21(31)14-25(18,4)16(17)7-9-26(22,28)5/h12,15-16,18,20-23,30-35H,7-11,13-14H2,1-6H3/t15-,16+,18+,20-,21+,22+,23-,25-,26-,27-,28-/m1/s1
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n/an/a 389n/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Binding affinity to Spodoptera frugiperda (fall armyworm) EcR


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ecdysone receptor/Ultraspiracle


(Leptinotarsa decemlineata)
BDBM50326777
PNG
((2beta,3beta,5beta,22R)-2,3,14,20,22,25-hexahydrox...)
Show SMILES CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C |r,t:16|
Show InChI InChI=1S/C27H44O7/c1-23(2,32)9-8-22(31)26(5,33)21-7-11-27(34)16-12-18(28)17-13-19(29)20(30)14-24(17,3)15(16)6-10-25(21,27)4/h12,15,17,19-22,29-34H,6-11,13-14H2,1-5H3/t15-,17-,19+,20-,21-,22+,24+,25+,26+,27+/m0/s1
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n/an/a 437n/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Binding affinity to Leptinotarsa decemlineata EcR


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle


(Nezara viridula)
BDBM50326777
PNG
((2beta,3beta,5beta,22R)-2,3,14,20,22,25-hexahydrox...)
Show SMILES CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C |r,t:16|
Show InChI InChI=1S/C27H44O7/c1-23(2,32)9-8-22(31)26(5,33)21-7-11-27(34)16-12-18(28)17-13-19(29)20(30)14-24(17,3)15(16)6-10-25(21,27)4/h12,15,17,19-22,29-34H,6-11,13-14H2,1-5H3/t15-,17-,19+,20-,21-,22+,24+,25+,26+,27+/m0/s1
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n/an/a 1.05E+3n/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Binding affinity to Nezara viridula EcR


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Protein ultraspiracle


(Drosophila melanogaster)
BDBM50226672
PNG
(CHEMBL255034 | makisterone A)
Show SMILES C[C@H](C[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C)C(C)(C)O |t:13|
Show InChI InChI=1S/C28H46O7/c1-15(24(2,3)33)11-23(32)27(6,34)22-8-10-28(35)17-12-19(29)18-13-20(30)21(31)14-25(18,4)16(17)7-9-26(22,28)5/h12,15-16,18,20-23,30-35H,7-11,13-14H2,1-6H3/t15-,16+,18+,20-,21+,22+,23-,25-,26-,27-,28-/m1/s1
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n/an/a 1.38E+3n/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Binding affinity to Drosophila melanogaster EcR


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ecdysone receptor/Ultraspiracle


(Nezara viridula)
BDBM50226672
PNG
(CHEMBL255034 | makisterone A)
Show SMILES C[C@H](C[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C)C(C)(C)O |t:13|
Show InChI InChI=1S/C28H46O7/c1-15(24(2,3)33)11-23(32)27(6,34)22-8-10-28(35)17-12-19(29)18-13-20(30)21(31)14-25(18,4)16(17)7-9-26(22,28)5/h12,15-16,18,20-23,30-35H,7-11,13-14H2,1-6H3/t15-,16+,18+,20-,21+,22+,23-,25-,26-,27-,28-/m1/s1
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n/an/a 1.38E+3n/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Binding affinity to Nezara viridula EcR


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle isoform B


(Leptinotarsa decemlineata)
BDBM50226672
PNG
(CHEMBL255034 | makisterone A)
Show SMILES C[C@H](C[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C)C(C)(C)O |t:13|
Show InChI InChI=1S/C28H46O7/c1-15(24(2,3)33)11-23(32)27(6,34)22-8-10-28(35)17-12-19(29)18-13-20(30)21(31)14-25(18,4)16(17)7-9-26(22,28)5/h12,15-16,18,20-23,30-35H,7-11,13-14H2,1-6H3/t15-,16+,18+,20-,21+,22+,23-,25-,26-,27-,28-/m1/s1
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n/an/a 1.74E+3n/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Binding affinity to Leptinotarsa decemlineata EcR


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle


(Nezara viridula)
BDBM50326777
PNG
((2beta,3beta,5beta,22R)-2,3,14,20,22,25-hexahydrox...)
Show SMILES CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C |r,t:16|
Show InChI InChI=1S/C27H44O7/c1-23(2,32)9-8-22(31)26(5,33)21-7-11-27(34)16-12-18(28)17-13-19(29)20(30)14-24(17,3)15(16)6-10-25(21,27)4/h12,15,17,19-22,29-34H,6-11,13-14H2,1-5H3/t15-,17-,19+,20-,21-,22+,24+,25+,26+,27+/m0/s1
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n/an/a 3.00E+3n/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]PonA from recombinant Nezara viridula EcR10


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle


(Nezara viridula)
BDBM50326777
PNG
((2beta,3beta,5beta,22R)-2,3,14,20,22,25-hexahydrox...)
Show SMILES CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C |r,t:16|
Show InChI InChI=1S/C27H44O7/c1-23(2,32)9-8-22(31)26(5,33)21-7-11-27(34)16-12-18(28)17-13-19(29)20(30)14-24(17,3)15(16)6-10-25(21,27)4/h12,15,17,19-22,29-34H,6-11,13-14H2,1-5H3/t15-,17-,19+,20-,21-,22+,24+,25+,26+,27+/m0/s1
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n/an/a 4.50E+3n/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]PonA from recombinant Nezara viridula EcR11


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle


(Nezara viridula)
BDBM50414646
PNG
(INOKOSTERONE)
Show SMILES C[C@H](CO)CC[C@H](O)[C@@](C)(O)[C@@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@H](O)[C@@H](O)C[C@@]4(C)[C@H]3CC[C@@]12C |r,t:16|
Show InChI InChI=1S/C27H44O7/c1-15(14-28)5-6-23(32)26(4,33)22-8-10-27(34)17-11-19(29)18-12-20(30)21(31)13-24(18,2)16(17)7-9-25(22,27)3/h11,15-16,18,20-23,28,30-34H,5-10,12-14H2,1-4H3/t15-,16-,18-,20-,21-,22+,23-,24-,25-,26-,27+/m0/s1
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n/an/a 7.00E+3n/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]PonA from recombinant Nezara viridula EcR11


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle


(Nezara viridula)
BDBM50414646
PNG
(INOKOSTERONE)
Show SMILES C[C@H](CO)CC[C@H](O)[C@@](C)(O)[C@@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@H](O)[C@@H](O)C[C@@]4(C)[C@H]3CC[C@@]12C |r,t:16|
Show InChI InChI=1S/C27H44O7/c1-15(14-28)5-6-23(32)26(4,33)22-8-10-27(34)17-11-19(29)18-12-20(30)21(31)13-24(18,2)16(17)7-9-25(22,27)3/h11,15-16,18,20-23,28,30-34H,5-10,12-14H2,1-4H3/t15-,16-,18-,20-,21-,22+,23-,24-,25-,26-,27+/m0/s1
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n/an/a 8.00E+3n/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]PonA from recombinant Nezara viridula EcR10


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle


(Nezara viridula)
BDBM50178988
PNG
(CHEBI:38452 | Tebufenozide)
Show SMILES CCc1ccc(cc1)C(=O)NN(C(=O)c1cc(C)cc(C)c1)C(C)(C)C
Show InChI InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)
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n/an/a 2.00E+4n/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]PonA from recombinant Nezara viridula EcR10


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle


(Nezara viridula)
BDBM50178988
PNG
(CHEBI:38452 | Tebufenozide)
Show SMILES CCc1ccc(cc1)C(=O)NN(C(=O)c1cc(C)cc(C)c1)C(C)(C)C
Show InChI InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)
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n/an/a 2.80E+4n/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]PonA from recombinant Nezara viridula EcR11


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle


(Nezara viridula)
BDBM50414651
PNG
(ECDYSONE)
Show SMILES C[C@H]([C@@H](O)CCC(C)(C)O)[C@@H]1CC[C@]2(O)C3=CC(=O)[C@@H]4C[C@H](O)[C@@H](O)C[C@@]4(C)[C@@H]3CC[C@@]12C |r,t:15,@@:6|
Show InChI InChI=1S/C27H44O6/c1-15(20(28)8-9-24(2,3)32)16-7-11-27(33)18-12-21(29)19-13-22(30)23(31)14-25(19,4)17(18)6-10-26(16,27)5/h12,15-17,19-20,22-23,28,30-33H,6-11,13-14H2,1-5H3/t15-,16-,17+,19-,20-,22-,23-,25-,26-,27-/m0/s1
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n/an/a 6.00E+4n/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]PonA from recombinant Nezara viridula EcR10


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair
Ultraspiracle


(Nezara viridula)
BDBM50414651
PNG
(ECDYSONE)
Show SMILES C[C@H]([C@@H](O)CCC(C)(C)O)[C@@H]1CC[C@]2(O)C3=CC(=O)[C@@H]4C[C@H](O)[C@@H](O)C[C@@]4(C)[C@@H]3CC[C@@]12C |r,t:15,@@:6|
Show InChI InChI=1S/C27H44O6/c1-15(20(28)8-9-24(2,3)32)16-7-11-27(33)18-12-21(29)19-13-22(30)23(31)14-25(19,4)17(18)6-10-26(16,27)5/h12,15-17,19-20,22-23,28,30-33H,6-11,13-14H2,1-5H3/t15-,16-,17+,19-,20-,22-,23-,25-,26-,27-/m0/s1
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n/an/a 6.00E+4n/an/an/an/an/an/a



CSIRO Materials Science and Engineering and CSIRO Food and Nutritional Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]PonA from recombinant Nezara viridula EcR11


Pest Manag Sci 67: 1457-67 (2011)


Article DOI: 10.1002/ps.2200
BindingDB Entry DOI: 10.7270/Q2B27Z6B
More data for this
Ligand-Target Pair