Compile Data Set for Download or QSAR
Found 14 Enz. Inhib. hit(s) with all data for entry = 50007417
TargetLanosterol synthase(Rattus norvegicus)
Università di Torino

Curated by ChEMBL
LigandPNGBDBM50062847(2,2-Dimethyl-3-(3,7,12,20-tetramethyl-16-vinyl-hen...)
Show SMILES CC(C)=CCC\C(C=C)=C\CCC(C)=CCCC=C(C)CCC=C(C)CCC1OC1(C)C
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+
Affinity DataIC50: 400nMAssay Description:Compound was tested for inhibition of solubilized and partially purified pig liver Oxidosqualene-lanosterol cyclaseMore data for this Ligand-Target Pair
TargetLanosterol synthase(Homo sapiens (Human))
Università di Torino

Curated by ChEMBL
LigandPNGBDBM50062847(2,2-Dimethyl-3-(3,7,12,20-tetramethyl-16-vinyl-hen...)
Show SMILES CC(C)=CCC\C(C=C)=C\CCC(C)=CCCC=C(C)CCC=C(C)CCC1OC1(C)C
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+
Affinity DataIC50: 1.00E+3nMAssay Description:Compound was tested for inhibition of solubilized and partially purified Saccharomyces cerevisae Oxidosqualene-lanosterol cyclaseMore data for this Ligand-Target Pair
TargetLanosterol synthase(Homo sapiens (Human))
Università di Torino

Curated by ChEMBL
LigandPNGBDBM50062849(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+
Affinity DataIC50: 1.50E+3nMAssay Description:Compound was tested for inhibition of solubilized and partially purified Saccharomyces cerevisae Oxidosqualene-lanosterol cyclaseMore data for this Ligand-Target Pair
TargetLanosterol synthase(Rattus norvegicus)
Università di Torino

Curated by ChEMBL
LigandPNGBDBM50062849(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+
Affinity DataIC50: 3.50E+3nMAssay Description:Compound was tested for inhibition of solubilized and partially purified pig liver Oxidosqualene-lanosterol cyclaseMore data for this Ligand-Target Pair
TargetLanosterol synthase(Rattus norvegicus)
Università di Torino

Curated by ChEMBL
LigandPNGBDBM50062848(2,2-Dimethyl-3-(3,7,12,20-tetramethyl-16-vinyl-hen...)
Show SMILES CC(C)=CCC\C(C=C)=C/CCC(C)=CCCC=C(C)CCC=C(C)CCC1OC1(C)C
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-
Affinity DataIC50: 4.00E+3nMAssay Description:Compound was tested for inhibition of solubilized and partially purified pig liver Oxidosqualene-lanosterol cyclaseMore data for this Ligand-Target Pair
TargetLanosterol synthase(Homo sapiens (Human))
Università di Torino

Curated by ChEMBL
LigandPNGBDBM50062848(2,2-Dimethyl-3-(3,7,12,20-tetramethyl-16-vinyl-hen...)
Show SMILES CC(C)=CCC\C(C=C)=C/CCC(C)=CCCC=C(C)CCC=C(C)CCC1OC1(C)C
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-
Affinity DataIC50: 5.00E+3nMAssay Description:Compound was tested for inhibition of solubilized and partially purified Saccharomyces cerevisae Oxidosqualene-lanosterol cyclaseMore data for this Ligand-Target Pair
TargetLanosterol synthase(Rattus norvegicus)
Università di Torino

Curated by ChEMBL
LigandPNGBDBM50062851(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+
Affinity DataIC50: 1.50E+4nMAssay Description:Compound was tested for inhibition of solubilized and partially purified pig liver Oxidosqualene-lanosterol cyclaseMore data for this Ligand-Target Pair
TargetLanosterol synthase(Homo sapiens (Human))
Università di Torino

Curated by ChEMBL
LigandPNGBDBM50062850(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+
Affinity DataIC50: 1.50E+4nMAssay Description:Compound was tested for inhibition of solubilized and partially purified Saccharomyces cerevisae Oxidosqualene-lanosterol cyclaseMore data for this Ligand-Target Pair
TargetLanosterol synthase(Homo sapiens (Human))
Università di Torino

Curated by ChEMBL
LigandPNGBDBM50062846(2,2-Dimethyl-3-(3,7,12,19-tetramethyl-16-vinyl-ico...)
Show SMILES CC(C)=CC\C(C=C)=C/CCC(C)=CCCC=C(C)CCC=C(C)CCC1OC1(C)C
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-
Affinity DataIC50: 1.80E+4nMAssay Description:Compound was tested for inhibition of solubilized and partially purified Saccharomyces cerevisae Oxidosqualene-lanosterol cyclaseMore data for this Ligand-Target Pair
TargetLanosterol synthase(Rattus norvegicus)
Università di Torino

Curated by ChEMBL
LigandPNGBDBM50062850(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+
Affinity DataIC50: 2.00E+4nMAssay Description:Compound was tested for inhibition of solubilized and partially purified pig liver Oxidosqualene-lanosterol cyclaseMore data for this Ligand-Target Pair
TargetLanosterol synthase(Rattus norvegicus)
Università di Torino

Curated by ChEMBL
LigandPNGBDBM50062846(2,2-Dimethyl-3-(3,7,12,19-tetramethyl-16-vinyl-ico...)
Show SMILES CC(C)=CC\C(C=C)=C/CCC(C)=CCCC=C(C)CCC=C(C)CCC1OC1(C)C
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-
Affinity DataIC50: 3.20E+4nMAssay Description:Compound was tested for inhibition of solubilized and partially purified pig liver Oxidosqualene-lanosterol cyclaseMore data for this Ligand-Target Pair
TargetLanosterol synthase(Homo sapiens (Human))
Università di Torino

Curated by ChEMBL
LigandPNGBDBM50062851(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+
Affinity DataIC50: 7.00E+4nMAssay Description:Compound was tested for inhibition of solubilized and partially purified Saccharomyces cerevisae Oxidosqualene-lanosterol cyclaseMore data for this Ligand-Target Pair
TargetLanosterol synthase(Homo sapiens (Human))
Università di Torino

Curated by ChEMBL
LigandPNGBDBM50062845(2,2-Dimethyl-3-(3,7,12,20-tetramethyl-16-vinyl-hen...)
Show SMILES CC(C)=CCCC(CCCC(C)=CCCC=C(C)CCC=C(C)CCC1OC1(C)C)C=C
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+
Affinity DataIC50: 1.00E+5nMAssay Description:Compound was tested for inhibition of solubilized and partially purified Saccharomyces cerevisae Oxidosqualene-lanosterol cyclaseMore data for this Ligand-Target Pair
TargetLanosterol synthase(Rattus norvegicus)
Università di Torino

Curated by ChEMBL
LigandPNGBDBM50062845(2,2-Dimethyl-3-(3,7,12,20-tetramethyl-16-vinyl-hen...)
Show SMILES CC(C)=CCCC(CCCC(C)=CCCC=C(C)CCC=C(C)CCC1OC1(C)C)C=C
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+
Affinity DataIC50: 1.00E+5nMAssay Description:Compound was tested for inhibition of solubilized and partially purified pig liver Oxidosqualene-lanosterol cyclaseMore data for this Ligand-Target Pair