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Compile Data Set for Download or QSAR

Found 6 hits Enz. Inhib. hit(s) with Target = 'Regulatory protein E2'   
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
Regulatory protein E2


(Human papillomavirus type 1a)
BDBM50035218
PNG
(CHEMBL61 | PODOFILOX | Podophyllinic acid lactone ...)
Show SMILES COc1cc(cc(OC)c1OC)[C@H]1[C@@H]2[C@H](COC2=O)[C@@H](O)c2cc3OCOc3cc12
Show InChI InChI=1S/C22H22O8/c1-25-16-4-10(5-17(26-2)21(16)27-3)18-11-6-14-15(30-9-29-14)7-12(11)20(23)13-8-28-22(24)19(13)18/h4-7,13,18-20,23H,8-9H2,1-3H3/t13-,18+,19-,20-/m0/s1
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PubMed
n/an/an/a 1.05E+3n/an/an/an/an/a



Tokyo University of Science

Curated by ChEMBL


Assay Description
Binding affinity to HPV1a recombinant E2 protein hinge domain by surface plasmon resonance assay


Bioorg Med Chem 16: 5815-25 (2008)


Article DOI: 10.1016/j.bmc.2008.03.053
BindingDB Entry DOI: 10.7270/Q24B3136
More data for this
Ligand-Target Pair
Regulatory protein E2


(Human papillomavirus type 11)
BDBM50035218
PNG
(CHEMBL61 | PODOFILOX | Podophyllinic acid lactone ...)
Show SMILES COc1cc(cc(OC)c1OC)[C@H]1[C@@H]2[C@H](COC2=O)[C@@H](O)c2cc3OCOc3cc12
Show InChI InChI=1S/C22H22O8/c1-25-16-4-10(5-17(26-2)21(16)27-3)18-11-6-14-15(30-9-29-14)7-12(11)20(23)13-8-28-22(24)19(13)18/h4-7,13,18-20,23H,8-9H2,1-3H3/t13-,18+,19-,20-/m0/s1
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PubMed
n/an/an/a 2.01E+4n/an/an/an/an/a



Tokyo University of Science

Curated by ChEMBL


Assay Description
Binding affinity to HPV11 recombinant E2 protein by surface plasmon resonance method


Bioorg Med Chem 16: 5815-25 (2008)


Article DOI: 10.1016/j.bmc.2008.03.053
BindingDB Entry DOI: 10.7270/Q24B3136
More data for this
Ligand-Target Pair
Regulatory protein E2


(Human papillomavirus type 1a)
BDBM50035218
PNG
(CHEMBL61 | PODOFILOX | Podophyllinic acid lactone ...)
Show SMILES COc1cc(cc(OC)c1OC)[C@H]1[C@@H]2[C@H](COC2=O)[C@@H](O)c2cc3OCOc3cc12
Show InChI InChI=1S/C22H22O8/c1-25-16-4-10(5-17(26-2)21(16)27-3)18-11-6-14-15(30-9-29-14)7-12(11)20(23)13-8-28-22(24)19(13)18/h4-7,13,18-20,23H,8-9H2,1-3H3/t13-,18+,19-,20-/m0/s1
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PubMed
n/an/an/a 2.41E+4n/an/an/an/an/a



Tokyo University of Science

Curated by ChEMBL


Assay Description
Binding affinity to HPV1a recombinant E2 protein by surface plasmon resonance method


Bioorg Med Chem 16: 5815-25 (2008)


Article DOI: 10.1016/j.bmc.2008.03.053
BindingDB Entry DOI: 10.7270/Q24B3136
More data for this
Ligand-Target Pair
Regulatory protein E2


(Human papillomavirus type 1a)
BDBM50127140
PNG
((-)-etoposide | (5S,5aR,8aR,9R)-9-(4-hydroxy-3,5-d...)
Show SMILES COc1cc(cc(OC)c1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](O[C@@H]2O[C@@H]3CO[C@@H](C)O[C@H]3[C@H](O)[C@H]2O)c2cc3OCOc3cc12
Show InChI InChI=1S/C29H32O13/c1-11-36-9-20-27(40-11)24(31)25(32)29(41-20)42-26-14-7-17-16(38-10-39-17)6-13(14)21(22-15(26)8-37-28(22)33)12-4-18(34-2)23(30)19(5-12)35-3/h4-7,11,15,20-22,24-27,29-32H,8-10H2,1-3H3/t11-,15+,20-,21-,22+,24-,25-,26-,27-,29+/m1/s1
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Article
PubMed
n/an/an/a 2.10E+5n/an/an/an/an/a



Tokyo University of Science

Curated by ChEMBL


Assay Description
Binding affinity to HPV1a recombinant E2 protein by surface plasmon resonance method


Bioorg Med Chem 16: 5815-25 (2008)


Article DOI: 10.1016/j.bmc.2008.03.053
BindingDB Entry DOI: 10.7270/Q24B3136
More data for this
Ligand-Target Pair
Regulatory protein E2


(Human papillomavirus type 1a)
BDBM50035218
PNG
(CHEMBL61 | PODOFILOX | Podophyllinic acid lactone ...)
Show SMILES COc1cc(cc(OC)c1OC)[C@H]1[C@@H]2[C@H](COC2=O)[C@@H](O)c2cc3OCOc3cc12
Show InChI InChI=1S/C22H22O8/c1-25-16-4-10(5-17(26-2)21(16)27-3)18-11-6-14-15(30-9-29-14)7-12(11)20(23)13-8-28-22(24)19(13)18/h4-7,13,18-20,23H,8-9H2,1-3H3/t13-,18+,19-,20-/m0/s1
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PubMed
n/an/an/a>4.00E+5n/an/an/an/an/a



Tokyo University of Science

Curated by ChEMBL


Assay Description
Binding affinity to HPV1a recombinant E2 protein DNA binding domain by surface plasmon resonance assay


Bioorg Med Chem 16: 5815-25 (2008)


Article DOI: 10.1016/j.bmc.2008.03.053
BindingDB Entry DOI: 10.7270/Q24B3136
More data for this
Ligand-Target Pair
Regulatory protein E2


(Human papillomavirus type 1a)
BDBM50035218
PNG
(CHEMBL61 | PODOFILOX | Podophyllinic acid lactone ...)
Show SMILES COc1cc(cc(OC)c1OC)[C@H]1[C@@H]2[C@H](COC2=O)[C@@H](O)c2cc3OCOc3cc12
Show InChI InChI=1S/C22H22O8/c1-25-16-4-10(5-17(26-2)21(16)27-3)18-11-6-14-15(30-9-29-14)7-12(11)20(23)13-8-28-22(24)19(13)18/h4-7,13,18-20,23H,8-9H2,1-3H3/t13-,18+,19-,20-/m0/s1
UniProtKB/SwissProt

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CHEMBL
KEGG
PC cid
PC sid
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Article
PubMed
n/an/an/a>4.00E+5n/an/an/an/an/a



Tokyo University of Science

Curated by ChEMBL


Assay Description
Binding affinity to HPV1a recombinant E2 protein activator domain by surface plasmon resonance assay


Bioorg Med Chem 16: 5815-25 (2008)


Article DOI: 10.1016/j.bmc.2008.03.053
BindingDB Entry DOI: 10.7270/Q24B3136
More data for this
Ligand-Target Pair