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Compile Data Set for Download or QSAR

Found 14 hits with Last Name = 'milla' and Initial = 'p'   
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
Lanosterol synthase


(Rattus norvegicus)
BDBM50062847
PNG
(2,2-Dimethyl-3-(3,7,12,20-tetramethyl-16-vinyl-hen...)
Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6]=[#6])=[#6]\[#6]-[#6]-[#6](-[#6])=[#6]-[#6]-[#6]-[#6]=[#6](-[#6])-[#6]-[#6]-[#6]=[#6](-[#6])-[#6]-[#6]-[#6]1-[#8]C1([#6])[#6]
Show InChI InChI=1S/C31H50O/c1-9-29(21-12-15-25(2)3)22-14-20-27(5)17-11-10-16-26(4)18-13-19-28(6)23-24-30-31(7,8)32-30/h9,15-17,19,22,30H,1,10-14,18,20-21,23-24H2,2-8H3/b26-16+,27-17+,28-19+,29-22+
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n/an/a 400n/an/an/an/an/an/a



Università di Torino

Curated by ChEMBL


Assay Description
Compound was tested for inhibition of solubilized and partially purified pig liver Oxidosqualene-lanosterol cyclase


J Med Chem 41: 540-54 (1998)


Article DOI: 10.1021/jm970534j
BindingDB Entry DOI: 10.7270/Q2WQ02XV
More data for this
Ligand-Target Pair
Lanosterol synthase


(Homo sapiens (Human))
BDBM50062847
PNG
(2,2-Dimethyl-3-(3,7,12,20-tetramethyl-16-vinyl-hen...)
Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6]=[#6])=[#6]\[#6]-[#6]-[#6](-[#6])=[#6]-[#6]-[#6]-[#6]=[#6](-[#6])-[#6]-[#6]-[#6]=[#6](-[#6])-[#6]-[#6]-[#6]1-[#8]C1([#6])[#6]
Show InChI InChI=1S/C31H50O/c1-9-29(21-12-15-25(2)3)22-14-20-27(5)17-11-10-16-26(4)18-13-19-28(6)23-24-30-31(7,8)32-30/h9,15-17,19,22,30H,1,10-14,18,20-21,23-24H2,2-8H3/b26-16+,27-17+,28-19+,29-22+
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n/an/a 1.00E+3n/an/an/an/an/an/a



Università di Torino

Curated by ChEMBL


Assay Description
Compound was tested for inhibition of solubilized and partially purified Saccharomyces cerevisae Oxidosqualene-lanosterol cyclase


J Med Chem 41: 540-54 (1998)


Article DOI: 10.1021/jm970534j
BindingDB Entry DOI: 10.7270/Q2WQ02XV
More data for this
Ligand-Target Pair
Lanosterol synthase


(Homo sapiens (Human))
BDBM50062849
PNG
(2,2-Dimethyl-3-(3,7,12-trimethyl-octadeca-3,7,11,1...)
Show SMILES CC(CC\C=C\C=C)=CCCC=C(C)CCC=C(C)CCC1OC1(C)C
Show InChI InChI=1S/C25H40O/c1-7-8-9-10-14-21(2)15-11-12-16-22(3)17-13-18-23(4)19-20-24-25(5,6)26-24/h7-9,15-16,18,24H,1,10-14,17,19-20H2,2-6H3/b9-8+,21-15+,22-16+,23-18+
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n/an/a 1.50E+3n/an/an/an/an/an/a



Università di Torino

Curated by ChEMBL


Assay Description
Compound was tested for inhibition of solubilized and partially purified Saccharomyces cerevisae Oxidosqualene-lanosterol cyclase


J Med Chem 41: 540-54 (1998)


Article DOI: 10.1021/jm970534j
BindingDB Entry DOI: 10.7270/Q2WQ02XV
More data for this
Ligand-Target Pair
Lanosterol synthase


(Rattus norvegicus)
BDBM50062849
PNG
(2,2-Dimethyl-3-(3,7,12-trimethyl-octadeca-3,7,11,1...)
Show SMILES CC(CC\C=C\C=C)=CCCC=C(C)CCC=C(C)CCC1OC1(C)C
Show InChI InChI=1S/C25H40O/c1-7-8-9-10-14-21(2)15-11-12-16-22(3)17-13-18-23(4)19-20-24-25(5,6)26-24/h7-9,15-16,18,24H,1,10-14,17,19-20H2,2-6H3/b9-8+,21-15+,22-16+,23-18+
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n/an/a 3.50E+3n/an/an/an/an/an/a



Università di Torino

Curated by ChEMBL


Assay Description
Compound was tested for inhibition of solubilized and partially purified pig liver Oxidosqualene-lanosterol cyclase


J Med Chem 41: 540-54 (1998)


Article DOI: 10.1021/jm970534j
BindingDB Entry DOI: 10.7270/Q2WQ02XV
More data for this
Ligand-Target Pair
Lanosterol synthase


(Rattus norvegicus)
BDBM50062848
PNG
(2,2-Dimethyl-3-(3,7,12,20-tetramethyl-16-vinyl-hen...)
Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6]=[#6])=[#6]/[#6]-[#6]-[#6](-[#6])=[#6]-[#6]-[#6]-[#6]=[#6](-[#6])-[#6]-[#6]-[#6]=[#6](-[#6])-[#6]-[#6]-[#6]1-[#8]C1([#6])[#6]
Show InChI InChI=1S/C31H50O/c1-9-29(21-12-15-25(2)3)22-14-20-27(5)17-11-10-16-26(4)18-13-19-28(6)23-24-30-31(7,8)32-30/h9,15-17,19,22,30H,1,10-14,18,20-21,23-24H2,2-8H3/b26-16+,27-17+,28-19+,29-22-
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n/an/a 4.00E+3n/an/an/an/an/an/a



Università di Torino

Curated by ChEMBL


Assay Description
Compound was tested for inhibition of solubilized and partially purified pig liver Oxidosqualene-lanosterol cyclase


J Med Chem 41: 540-54 (1998)


Article DOI: 10.1021/jm970534j
BindingDB Entry DOI: 10.7270/Q2WQ02XV
More data for this
Ligand-Target Pair
Lanosterol synthase


(Homo sapiens (Human))
BDBM50062848
PNG
(2,2-Dimethyl-3-(3,7,12,20-tetramethyl-16-vinyl-hen...)
Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6]=[#6])=[#6]/[#6]-[#6]-[#6](-[#6])=[#6]-[#6]-[#6]-[#6]=[#6](-[#6])-[#6]-[#6]-[#6]=[#6](-[#6])-[#6]-[#6]-[#6]1-[#8]C1([#6])[#6]
Show InChI InChI=1S/C31H50O/c1-9-29(21-12-15-25(2)3)22-14-20-27(5)17-11-10-16-26(4)18-13-19-28(6)23-24-30-31(7,8)32-30/h9,15-17,19,22,30H,1,10-14,18,20-21,23-24H2,2-8H3/b26-16+,27-17+,28-19+,29-22-
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n/an/a 5.00E+3n/an/an/an/an/an/a



Università di Torino

Curated by ChEMBL


Assay Description
Compound was tested for inhibition of solubilized and partially purified Saccharomyces cerevisae Oxidosqualene-lanosterol cyclase


J Med Chem 41: 540-54 (1998)


Article DOI: 10.1021/jm970534j
BindingDB Entry DOI: 10.7270/Q2WQ02XV
More data for this
Ligand-Target Pair
Lanosterol synthase


(Rattus norvegicus)
BDBM50062851
PNG
(2,2-Dimethyl-3-(3,7,12-trimethyl-hexadeca-3,7,11,1...)
Show SMILES CC(CCC=C)=CCCC=C(C)CCC=C(C)CCC1OC1(C)C
Show InChI InChI=1S/C23H38O/c1-7-8-12-19(2)13-9-10-14-20(3)15-11-16-21(4)17-18-22-23(5,6)24-22/h7,13-14,16,22H,1,8-12,15,17-18H2,2-6H3/b19-13+,20-14+,21-16+
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n/an/a 1.50E+4n/an/an/an/an/an/a



Università di Torino

Curated by ChEMBL


Assay Description
Compound was tested for inhibition of solubilized and partially purified pig liver Oxidosqualene-lanosterol cyclase


J Med Chem 41: 540-54 (1998)


Article DOI: 10.1021/jm970534j
BindingDB Entry DOI: 10.7270/Q2WQ02XV
More data for this
Ligand-Target Pair
Lanosterol synthase


(Homo sapiens (Human))
BDBM50062850
PNG
(2,2-Dimethyl-3-(3,7,12-trimethyl-octadeca-3,7,11,1...)
Show SMILES CC(CC\C=C/C=C)=CCCC=C(C)CC\C=C(/C)CCC1OC1(C)C
Show InChI InChI=1S/C25H40O/c1-7-8-9-10-14-21(2)15-11-12-16-22(3)17-13-18-23(4)19-20-24-25(5,6)26-24/h7-9,15-16,18,24H,1,10-14,17,19-20H2,2-6H3/b9-8-,21-15+,22-16+,23-18+
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n/an/a 1.50E+4n/an/an/an/an/an/a



Università di Torino

Curated by ChEMBL


Assay Description
Compound was tested for inhibition of solubilized and partially purified Saccharomyces cerevisae Oxidosqualene-lanosterol cyclase


J Med Chem 41: 540-54 (1998)


Article DOI: 10.1021/jm970534j
BindingDB Entry DOI: 10.7270/Q2WQ02XV
More data for this
Ligand-Target Pair
Lanosterol synthase


(Homo sapiens (Human))
BDBM50062846
PNG
(2,2-Dimethyl-3-(3,7,12,19-tetramethyl-16-vinyl-ico...)
Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]\[#6](-[#6]=[#6])=[#6]/[#6]-[#6]-[#6](-[#6])=[#6]-[#6]-[#6]-[#6]=[#6](-[#6])-[#6]-[#6]-[#6]=[#6](-[#6])-[#6]-[#6]-[#6]1-[#8]C1([#6])[#6]
Show InChI InChI=1S/C30H48O/c1-9-28(22-20-24(2)3)19-13-18-26(5)15-11-10-14-25(4)16-12-17-27(6)21-23-29-30(7,8)31-29/h9,14-15,17,19-20,29H,1,10-13,16,18,21-23H2,2-8H3/b25-14+,26-15+,27-17+,28-19-
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n/an/a 1.80E+4n/an/an/an/an/an/a



Università di Torino

Curated by ChEMBL


Assay Description
Compound was tested for inhibition of solubilized and partially purified Saccharomyces cerevisae Oxidosqualene-lanosterol cyclase


J Med Chem 41: 540-54 (1998)


Article DOI: 10.1021/jm970534j
BindingDB Entry DOI: 10.7270/Q2WQ02XV
More data for this
Ligand-Target Pair
Lanosterol synthase


(Rattus norvegicus)
BDBM50062850
PNG
(2,2-Dimethyl-3-(3,7,12-trimethyl-octadeca-3,7,11,1...)
Show SMILES CC(CC\C=C/C=C)=CCCC=C(C)CC\C=C(/C)CCC1OC1(C)C
Show InChI InChI=1S/C25H40O/c1-7-8-9-10-14-21(2)15-11-12-16-22(3)17-13-18-23(4)19-20-24-25(5,6)26-24/h7-9,15-16,18,24H,1,10-14,17,19-20H2,2-6H3/b9-8-,21-15+,22-16+,23-18+
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n/an/a 2.00E+4n/an/an/an/an/an/a



Università di Torino

Curated by ChEMBL


Assay Description
Compound was tested for inhibition of solubilized and partially purified pig liver Oxidosqualene-lanosterol cyclase


J Med Chem 41: 540-54 (1998)


Article DOI: 10.1021/jm970534j
BindingDB Entry DOI: 10.7270/Q2WQ02XV
More data for this
Ligand-Target Pair
Lanosterol synthase


(Rattus norvegicus)
BDBM50062846
PNG
(2,2-Dimethyl-3-(3,7,12,19-tetramethyl-16-vinyl-ico...)
Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]\[#6](-[#6]=[#6])=[#6]/[#6]-[#6]-[#6](-[#6])=[#6]-[#6]-[#6]-[#6]=[#6](-[#6])-[#6]-[#6]-[#6]=[#6](-[#6])-[#6]-[#6]-[#6]1-[#8]C1([#6])[#6]
Show InChI InChI=1S/C30H48O/c1-9-28(22-20-24(2)3)19-13-18-26(5)15-11-10-14-25(4)16-12-17-27(6)21-23-29-30(7,8)31-29/h9,14-15,17,19-20,29H,1,10-13,16,18,21-23H2,2-8H3/b25-14+,26-15+,27-17+,28-19-
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n/an/a 3.20E+4n/an/an/an/an/an/a



Università di Torino

Curated by ChEMBL


Assay Description
Compound was tested for inhibition of solubilized and partially purified pig liver Oxidosqualene-lanosterol cyclase


J Med Chem 41: 540-54 (1998)


Article DOI: 10.1021/jm970534j
BindingDB Entry DOI: 10.7270/Q2WQ02XV
More data for this
Ligand-Target Pair
Lanosterol synthase


(Homo sapiens (Human))
BDBM50062851
PNG
(2,2-Dimethyl-3-(3,7,12-trimethyl-hexadeca-3,7,11,1...)
Show SMILES CC(CCC=C)=CCCC=C(C)CCC=C(C)CCC1OC1(C)C
Show InChI InChI=1S/C23H38O/c1-7-8-12-19(2)13-9-10-14-20(3)15-11-16-21(4)17-18-22-23(5,6)24-22/h7,13-14,16,22H,1,8-12,15,17-18H2,2-6H3/b19-13+,20-14+,21-16+
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n/an/a 7.00E+4n/an/an/an/an/an/a



Università di Torino

Curated by ChEMBL


Assay Description
Compound was tested for inhibition of solubilized and partially purified Saccharomyces cerevisae Oxidosqualene-lanosterol cyclase


J Med Chem 41: 540-54 (1998)


Article DOI: 10.1021/jm970534j
BindingDB Entry DOI: 10.7270/Q2WQ02XV
More data for this
Ligand-Target Pair
Lanosterol synthase


(Homo sapiens (Human))
BDBM50062845
PNG
(2,2-Dimethyl-3-(3,7,12,20-tetramethyl-16-vinyl-hen...)
Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-[#6]-[#6](-[#6]-[#6]-[#6]-[#6](-[#6])=[#6]-[#6]-[#6]-[#6]=[#6](-[#6])-[#6]-[#6]-[#6]=[#6](-[#6])-[#6]-[#6]-[#6]1-[#8]C1([#6])[#6])-[#6]=[#6]
Show InChI InChI=1S/C31H52O/c1-9-29(21-12-15-25(2)3)22-14-20-27(5)17-11-10-16-26(4)18-13-19-28(6)23-24-30-31(7,8)32-30/h9,15-17,19,29-30H,1,10-14,18,20-24H2,2-8H3/b26-16+,27-17+,28-19+
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n/an/a>1.00E+5n/an/an/an/an/an/a



Università di Torino

Curated by ChEMBL


Assay Description
Compound was tested for inhibition of solubilized and partially purified Saccharomyces cerevisae Oxidosqualene-lanosterol cyclase


J Med Chem 41: 540-54 (1998)


Article DOI: 10.1021/jm970534j
BindingDB Entry DOI: 10.7270/Q2WQ02XV
More data for this
Ligand-Target Pair
Lanosterol synthase


(Rattus norvegicus)
BDBM50062845
PNG
(2,2-Dimethyl-3-(3,7,12,20-tetramethyl-16-vinyl-hen...)
Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-[#6]-[#6](-[#6]-[#6]-[#6]-[#6](-[#6])=[#6]-[#6]-[#6]-[#6]=[#6](-[#6])-[#6]-[#6]-[#6]=[#6](-[#6])-[#6]-[#6]-[#6]1-[#8]C1([#6])[#6])-[#6]=[#6]
Show InChI InChI=1S/C31H52O/c1-9-29(21-12-15-25(2)3)22-14-20-27(5)17-11-10-16-26(4)18-13-19-28(6)23-24-30-31(7,8)32-30/h9,15-17,19,29-30H,1,10-14,18,20-24H2,2-8H3/b26-16+,27-17+,28-19+
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n/an/a 1.00E+5n/an/an/an/an/an/a



Università di Torino

Curated by ChEMBL


Assay Description
Compound was tested for inhibition of solubilized and partially purified pig liver Oxidosqualene-lanosterol cyclase


J Med Chem 41: 540-54 (1998)


Article DOI: 10.1021/jm970534j
BindingDB Entry DOI: 10.7270/Q2WQ02XV
More data for this
Ligand-Target Pair