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Compile Data Set for Download or QSAR

Found 45 hits from Alexandru Ioan Cuza University   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50067584
PNG
((S)-2-{[5-((R)-2-Amino-3-mercapto-propylamino)-bip...)
Show SMILES CSCC[C@H](NC(=O)c1ccc(NC[C@@H](N)CS)cc1-c1ccccc1)C(O)=O
Show InChI InChI=1S/C21H27N3O3S2/c1-29-10-9-19(21(26)27)24-20(25)17-8-7-16(23-12-15(22)13-28)11-18(17)14-5-3-2-4-6-14/h2-8,11,15,19,23,28H,9-10,12-13,22H2,1H3,(H,24,25)(H,26,27)/t15-,19+/m1/s1
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n/an/a 7n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using farnesylpyrophosphate and dansyl-GCVLS as substrate measured for 15 mins by fluorescence as...


Bioorg Med Chem Lett 26: 3730-4 (2016)


Article DOI: 10.1016/j.bmcl.2016.05.074
BindingDB Entry DOI: 10.7270/Q2DR2XFP
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50189292
PNG
(CHEMBL3828157)
Show SMILES CCOC(=O)c1cc(C(=O)\C=C\c2ccc3N(C)c4ccccc4Sc3c2)n2ccccc12
Show InChI InChI=1S/C27H22N2O3S/c1-3-32-27(31)19-17-23(29-15-7-6-8-20(19)29)24(30)14-12-18-11-13-22-26(16-18)33-25-10-5-4-9-21(25)28(22)2/h4-17H,3H2,1-2H3/b14-12+
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n/an/a 9n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using farnesylpyrophosphate and dansyl-GCVLS as substrate measured for 15 mins by fluorescence as...


Bioorg Med Chem Lett 26: 3730-4 (2016)


Article DOI: 10.1016/j.bmcl.2016.05.074
BindingDB Entry DOI: 10.7270/Q2DR2XFP
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50189293
PNG
(CHEMBL3827279)
Show SMILES CCOC(=O)c1cc(C(=O)\C=C\c2ccc3N(C)c4ccccc4Sc3c2)n2c(C)cccc12
Show InChI InChI=1S/C28H24N2O3S/c1-4-33-28(32)20-17-24(30-18(2)8-7-10-21(20)30)25(31)15-13-19-12-14-23-27(16-19)34-26-11-6-5-9-22(26)29(23)3/h5-17H,4H2,1-3H3/b15-13+
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n/an/a 23n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using farnesylpyrophosphate and dansyl-GCVLS as substrate measured for 15 mins by fluorescence as...


Bioorg Med Chem Lett 26: 3730-4 (2016)


Article DOI: 10.1016/j.bmcl.2016.05.074
BindingDB Entry DOI: 10.7270/Q2DR2XFP
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50189295
PNG
(CHEMBL3828384)
Show SMILES CCOC(=O)c1cc(C(=O)\C=C\c2ccc3N(C)c4ccccc4Sc3c2)n2ccc(C)cc12
Show InChI InChI=1S/C28H24N2O3S/c1-4-33-28(32)20-17-24(30-14-13-18(2)15-23(20)30)25(31)12-10-19-9-11-22-27(16-19)34-26-8-6-5-7-21(26)29(22)3/h5-17H,4H2,1-3H3/b12-10+
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n/an/a 155n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using farnesylpyrophosphate and dansyl-GCVLS as substrate measured for 15 mins by fluorescence as...


Bioorg Med Chem Lett 26: 3730-4 (2016)


Article DOI: 10.1016/j.bmcl.2016.05.074
BindingDB Entry DOI: 10.7270/Q2DR2XFP
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50059863
PNG
((Z)-2-Methyl-3-tetradecyl-but-2-enedioic acid | CH...)
Show SMILES CCCCCCCCCCCCCC\C(C(O)=O)=C(/C)C(O)=O
Show InChI InChI=1S/C19H34O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-17(19(22)23)16(2)18(20)21/h3-15H2,1-2H3,(H,20,21)(H,22,23)/b17-16-
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n/an/a 180n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using octyl-beta-D-glucopyranoside as substrate after 15 mins by fluorescence assay


Bioorg Med Chem Lett 24: 5777-81 (2014)


Article DOI: 10.1016/j.bmcl.2014.10.044
BindingDB Entry DOI: 10.7270/Q2W95BTK
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50059863
PNG
((Z)-2-Methyl-3-tetradecyl-but-2-enedioic acid | CH...)
Show SMILES CCCCCCCCCCCCCC\C(C(O)=O)=C(/C)C(O)=O
Show InChI InChI=1S/C19H34O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-17(19(22)23)16(2)18(20)21/h3-15H2,1-2H3,(H,20,21)(H,22,23)/b17-16-
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n/an/a 180n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using farnesylpyrophosphate and dansyl-GCVLS as substrate measured for 15 mins by fluorescence as...


Bioorg Med Chem Lett 26: 3730-4 (2016)


Article DOI: 10.1016/j.bmcl.2016.05.074
BindingDB Entry DOI: 10.7270/Q2DR2XFP
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50189304
PNG
(CHEMBL3827991)
Show SMILES CCOC(=O)c1cc(C(=O)\C=C\c2ccc(Br)cc2)n2ccc(OC)cc12
Show InChI InChI=1S/C21H18BrNO4/c1-3-27-21(25)17-13-19(23-11-10-16(26-2)12-18(17)23)20(24)9-6-14-4-7-15(22)8-5-14/h4-13H,3H2,1-2H3/b9-6+
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n/an/a 602n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using farnesylpyrophosphate and dansyl-GCVLS as substrate measured for 15 mins by fluorescence as...


Bioorg Med Chem Lett 26: 3730-4 (2016)


Article DOI: 10.1016/j.bmcl.2016.05.074
BindingDB Entry DOI: 10.7270/Q2DR2XFP
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50189297
PNG
(CHEMBL3828545)
Show SMILES CCOC(=O)c1cc(C(=O)\C=C\c2ccc3N(C)c4ccccc4Sc3c2)n2ccc(OC)cc12
Show InChI InChI=1S/C28H24N2O4S/c1-4-34-28(32)20-17-24(30-14-13-19(33-3)16-23(20)30)25(31)12-10-18-9-11-22-27(15-18)35-26-8-6-5-7-21(26)29(22)2/h5-17H,4H2,1-3H3/b12-10+
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n/an/a 711n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using farnesylpyrophosphate and dansyl-GCVLS as substrate measured for 15 mins by fluorescence as...


Bioorg Med Chem Lett 26: 3730-4 (2016)


Article DOI: 10.1016/j.bmcl.2016.05.074
BindingDB Entry DOI: 10.7270/Q2DR2XFP
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50189301
PNG
(CHEMBL3827237)
Show SMILES COc1cc(\C=C\C(=O)c2ccc3c(C)cc(C)cn23)cc(OC)c1OC
Show InChI InChI=1S/C22H23NO4/c1-14-10-15(2)17-7-8-18(23(17)13-14)19(24)9-6-16-11-20(25-3)22(27-5)21(12-16)26-4/h6-13H,1-5H3/b9-6+
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n/an/a 726n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using farnesylpyrophosphate and dansyl-GCVLS as substrate measured for 15 mins by fluorescence as...


Bioorg Med Chem Lett 26: 3730-4 (2016)


Article DOI: 10.1016/j.bmcl.2016.05.074
BindingDB Entry DOI: 10.7270/Q2DR2XFP
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50189302
PNG
(CHEMBL3827637)
Show SMILES CCOC(=O)c1cc(C(=O)\C=C\c2ccc(Cl)cc2)n2ccc(OC)cc12
Show InChI InChI=1S/C21H18ClNO4/c1-3-27-21(25)17-13-19(23-11-10-16(26-2)12-18(17)23)20(24)9-6-14-4-7-15(22)8-5-14/h4-13H,3H2,1-2H3/b9-6+
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n/an/a 931n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using farnesylpyrophosphate and dansyl-GCVLS as substrate measured for 15 mins by fluorescence as...


Bioorg Med Chem Lett 26: 3730-4 (2016)


Article DOI: 10.1016/j.bmcl.2016.05.074
BindingDB Entry DOI: 10.7270/Q2DR2XFP
More data for this
Ligand-Target Pair
Similar to alpha-tubulin isoform 1


(Bos taurus)
BDBM50156812
PNG
(PHENSTATIN)
Show SMILES COc1ccc(cc1O)C(=O)c1cc(OC)c(OC)c(OC)c1
Show InChI InChI=1S/C17H18O6/c1-20-13-6-5-10(7-12(13)18)16(19)11-8-14(21-2)17(23-4)15(9-11)22-3/h5-9,18H,1-4H3
UniProtKB/TrEMBL

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n/an/a 1.00E+3n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of bovine tubulin polymerization preincubated for 30 mins followed by GTP addition measured after 20 mins by spectrophotometric method


Bioorg Med Chem 24: 2307-17 (2016)


Article DOI: 10.1016/j.bmc.2016.04.001
BindingDB Entry DOI: 10.7270/Q2KW5HX2
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50036274
PNG
(CHEMBL3361086)
Show SMILES Cc1cccc2c(cc(C(=O)c3ccc(Br)cc3)n12)C(=O)OCC#C
Show InChI InChI=1S/C20H14BrNO3/c1-3-11-25-20(24)16-12-18(22-13(2)5-4-6-17(16)22)19(23)14-7-9-15(21)10-8-14/h1,4-10,12H,11H2,2H3
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n/an/a 1.30E+3n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using octyl-beta-D-glucopyranoside as substrate after 15 mins by fluorescence assay


Bioorg Med Chem Lett 24: 5777-81 (2014)


Article DOI: 10.1016/j.bmcl.2014.10.044
BindingDB Entry DOI: 10.7270/Q2W95BTK
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50189300
PNG
(CHEMBL3826996)
Show SMILES CCOC(=O)c1cc(C(=O)\C=C\c2ccc(cc2)-c2ccccc2)n2ccc(OC)cc12
Show InChI InChI=1S/C27H23NO4/c1-3-32-27(30)23-18-25(28-16-15-22(31-2)17-24(23)28)26(29)14-11-19-9-12-21(13-10-19)20-7-5-4-6-8-20/h4-18H,3H2,1-2H3/b14-11+
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n/an/a 1.32E+3n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using farnesylpyrophosphate and dansyl-GCVLS as substrate measured for 15 mins by fluorescence as...


Bioorg Med Chem Lett 26: 3730-4 (2016)


Article DOI: 10.1016/j.bmcl.2016.05.074
BindingDB Entry DOI: 10.7270/Q2DR2XFP
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50036270
PNG
(CHEMBL3361094)
Show SMILES Cc1cccc2c(cc(C(=O)c3ccc(Br)cc3)n12)C(=O)OCCC#C
Show InChI InChI=1S/C21H16BrNO3/c1-3-4-12-26-21(25)17-13-19(23-14(2)6-5-7-18(17)23)20(24)15-8-10-16(22)11-9-15/h1,5-11,13H,4,12H2,2H3
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n/an/a 2.20E+3n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using octyl-beta-D-glucopyranoside as substrate after 15 mins by fluorescence assay


Bioorg Med Chem Lett 24: 5777-81 (2014)


Article DOI: 10.1016/j.bmcl.2014.10.044
BindingDB Entry DOI: 10.7270/Q2W95BTK
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50189303
PNG
(CHEMBL3828130)
Show SMILES COc1ccn2c(cc(C(O)=O)c2c1)C(=O)\C=C\c1ccc(Cl)cc1
Show InChI InChI=1S/C19H14ClNO4/c1-25-14-8-9-21-16(10-14)15(19(23)24)11-17(21)18(22)7-4-12-2-5-13(20)6-3-12/h2-11H,1H3,(H,23,24)/b7-4+
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n/an/a 2.33E+3n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using farnesylpyrophosphate and dansyl-GCVLS as substrate measured for 15 mins by fluorescence as...


Bioorg Med Chem Lett 26: 3730-4 (2016)


Article DOI: 10.1016/j.bmcl.2016.05.074
BindingDB Entry DOI: 10.7270/Q2DR2XFP
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50035931
PNG
(CHEMBL3361085)
Show SMILES Cc1cccc2c(cc(C(=O)c3ccc(Cl)cc3)n12)C(=O)OCC#C
Show InChI InChI=1S/C20H14ClNO3/c1-3-11-25-20(24)16-12-18(22-13(2)5-4-6-17(16)22)19(23)14-7-9-15(21)10-8-14/h1,4-10,12H,11H2,2H3
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n/an/a 2.60E+3n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using octyl-beta-D-glucopyranoside as substrate after 15 mins by fluorescence assay


Bioorg Med Chem Lett 24: 5777-81 (2014)


Article DOI: 10.1016/j.bmcl.2014.10.044
BindingDB Entry DOI: 10.7270/Q2W95BTK
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50036277
PNG
(CHEMBL3361077)
Show SMILES Brc1ccc(cc1)C(=O)c1cc(C(=O)NCC#C)c2ccccn12
Show InChI InChI=1S/C19H13BrN2O2/c1-2-10-21-19(24)15-12-17(22-11-4-3-5-16(15)22)18(23)13-6-8-14(20)9-7-13/h1,3-9,11-12H,10H2,(H,21,24)
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n/an/a 4.40E+3n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using octyl-beta-D-glucopyranoside as substrate after 15 mins by fluorescence assay


Bioorg Med Chem Lett 24: 5777-81 (2014)


Article DOI: 10.1016/j.bmcl.2014.10.044
BindingDB Entry DOI: 10.7270/Q2W95BTK
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50498791
PNG
(CHEMBL3623716)
Show SMILES OC(=O)[C@H](CS)NC(=O)CCN1c2ccccc2Sc2ccccc12
Show InChI InChI=1S/C18H18N2O3S2/c21-17(19-12(11-24)18(22)23)9-10-20-13-5-1-3-7-15(13)25-16-8-4-2-6-14(16)20/h1-8,12,24H,9-11H2,(H,19,21)(H,22,23)/t12-/m0/s1
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n/an/a 4.70E+3n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human FTase using FPP/dansyl-GCVLS as substrate measured for 15 mins by fluorimetric analysis


Bioorg Med Chem Lett 25: 4447-52 (2015)

More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50036276
PNG
(CHEMBL3361076)
Show SMILES Clc1ccc(cc1)C(=O)c1cc(C(=O)NCC#C)c2ccccn12
Show InChI InChI=1S/C19H13ClN2O2/c1-2-10-21-19(24)15-12-17(22-11-4-3-5-16(15)22)18(23)13-6-8-14(20)9-7-13/h1,3-9,11-12H,10H2,(H,21,24)
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n/an/a 5.90E+3n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using octyl-beta-D-glucopyranoside as substrate after 15 mins by fluorescence assay


Bioorg Med Chem Lett 24: 5777-81 (2014)


Article DOI: 10.1016/j.bmcl.2014.10.044
BindingDB Entry DOI: 10.7270/Q2W95BTK
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50036272
PNG
(CHEMBL3361092)
Show SMILES Cc1cccc2c(cc(C(=O)c3ccccc3)n12)C(=O)OCCC#C
Show InChI InChI=1S/C21H17NO3/c1-3-4-13-25-21(24)17-14-19(20(23)16-10-6-5-7-11-16)22-15(2)9-8-12-18(17)22/h1,5-12,14H,4,13H2,2H3
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PubMed
n/an/a 7.30E+3n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using octyl-beta-D-glucopyranoside as substrate after 15 mins by fluorescence assay


Bioorg Med Chem Lett 24: 5777-81 (2014)


Article DOI: 10.1016/j.bmcl.2014.10.044
BindingDB Entry DOI: 10.7270/Q2W95BTK
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50189299
PNG
(CHEMBL3828274)
Show SMILES CCOC(=O)c1cc(C(=O)\C=C\c2ccc(cc2)C#N)n2ccc(OC)cc12
Show InChI InChI=1S/C22H18N2O4/c1-3-28-22(26)18-13-20(24-11-10-17(27-2)12-19(18)24)21(25)9-8-15-4-6-16(14-23)7-5-15/h4-13H,3H2,1-2H3/b9-8+
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PubMed
n/an/a 8.74E+3n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using farnesylpyrophosphate and dansyl-GCVLS as substrate measured for 15 mins by fluorescence as...


Bioorg Med Chem Lett 26: 3730-4 (2016)


Article DOI: 10.1016/j.bmcl.2016.05.074
BindingDB Entry DOI: 10.7270/Q2DR2XFP
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50035927
PNG
(CHEMBL3361080)
Show SMILES Cc1cccc2c(cc(C(=O)c3ccc(Br)cc3)n12)C(=O)NCC#C
Show InChI InChI=1S/C20H15BrN2O2/c1-3-11-22-20(25)16-12-18(23-13(2)5-4-6-17(16)23)19(24)14-7-9-15(21)10-8-14/h1,4-10,12H,11H2,2H3,(H,22,25)
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n/an/a 1.14E+4n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using octyl-beta-D-glucopyranoside as substrate after 15 mins by fluorescence assay


Bioorg Med Chem Lett 24: 5777-81 (2014)


Article DOI: 10.1016/j.bmcl.2014.10.044
BindingDB Entry DOI: 10.7270/Q2W95BTK
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50189294
PNG
(CHEMBL3827132)
Show SMILES CCOC(=O)c1cc(C(=O)\C=C\c2cc(OC)c(OC)c(OC)c2)n2ccc(OC)cc12
Show InChI InChI=1S/C24H25NO7/c1-6-32-24(27)17-14-19(25-10-9-16(28-2)13-18(17)25)20(26)8-7-15-11-21(29-3)23(31-5)22(12-15)30-4/h7-14H,6H2,1-5H3/b8-7+
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PubMed
n/an/a 1.16E+4n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using farnesylpyrophosphate and dansyl-GCVLS as substrate measured for 15 mins by fluorescence as...


Bioorg Med Chem Lett 26: 3730-4 (2016)


Article DOI: 10.1016/j.bmcl.2016.05.074
BindingDB Entry DOI: 10.7270/Q2DR2XFP
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50498787
PNG
(CHEMBL3623718)
Show SMILES CSCC[C@H](NC(=O)CCN1c2ccccc2Sc2ccccc12)C(O)=O
Show InChI InChI=1S/C20H22N2O3S2/c1-26-13-11-14(20(24)25)21-19(23)10-12-22-15-6-2-4-8-17(15)27-18-9-5-3-7-16(18)22/h2-9,14H,10-13H2,1H3,(H,21,23)(H,24,25)/t14-/m0/s1
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n/an/a 1.17E+4n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human FTase using FPP/dansyl-GCVLS as substrate measured for 15 mins by fluorimetric analysis


Bioorg Med Chem Lett 25: 4447-52 (2015)

More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50498792
PNG
(CHEMBL3623720)
Show SMILES OC[C@H](NC(=O)CCN1c2ccccc2Sc2ccccc12)C(O)=O
Show InChI InChI=1S/C18H18N2O4S/c21-11-12(18(23)24)19-17(22)9-10-20-13-5-1-3-7-15(13)25-16-8-4-2-6-14(16)20/h1-8,12,21H,9-11H2,(H,19,22)(H,23,24)/t12-/m0/s1
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n/an/a 1.20E+4n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human FTase using FPP/dansyl-GCVLS as substrate measured for 15 mins by fluorimetric analysis


Bioorg Med Chem Lett 25: 4447-52 (2015)

More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50035929
PNG
(CHEMBL3361082)
Show SMILES O=C(OCC#C)c1cc(C(=O)c2ccccc2)n2ccccc12
Show InChI InChI=1S/C19H13NO3/c1-2-12-23-19(22)15-13-17(20-11-7-6-10-16(15)20)18(21)14-8-4-3-5-9-14/h1,3-11,13H,12H2
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n/an/a 1.44E+4n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using octyl-beta-D-glucopyranoside as substrate after 15 mins by fluorescence assay


Bioorg Med Chem Lett 24: 5777-81 (2014)


Article DOI: 10.1016/j.bmcl.2014.10.044
BindingDB Entry DOI: 10.7270/Q2W95BTK
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50035921
PNG
(CHEMBL3361071)
Show SMILES Cc1cccc2c(cc(C(=O)c3ccc(Br)cc3)n12)C(O)=O
Show InChI InChI=1S/C17H12BrNO3/c1-10-3-2-4-14-13(17(21)22)9-15(19(10)14)16(20)11-5-7-12(18)8-6-11/h2-9H,1H3,(H,21,22)
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n/an/a 1.48E+4n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using octyl-beta-D-glucopyranoside as substrate after 15 mins by fluorescence assay


Bioorg Med Chem Lett 24: 5777-81 (2014)


Article DOI: 10.1016/j.bmcl.2014.10.044
BindingDB Entry DOI: 10.7270/Q2W95BTK
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50035926
PNG
(CHEMBL3361079)
Show SMILES Cc1cccc2c(cc(C(=O)c3ccc(Cl)cc3)n12)C(=O)NCC#C
Show InChI InChI=1S/C20H15ClN2O2/c1-3-11-22-20(25)16-12-18(23-13(2)5-4-6-17(16)23)19(24)14-7-9-15(21)10-8-14/h1,4-10,12H,11H2,2H3,(H,22,25)
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n/an/a 1.49E+4n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using octyl-beta-D-glucopyranoside as substrate after 15 mins by fluorescence assay


Bioorg Med Chem Lett 24: 5777-81 (2014)


Article DOI: 10.1016/j.bmcl.2014.10.044
BindingDB Entry DOI: 10.7270/Q2W95BTK
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50035928
PNG
(CHEMBL3361081)
Show SMILES Cc1ccn2c(cc(C(=O)NCC#C)c2c1)C(=O)c1ccccc1
Show InChI InChI=1S/C20H16N2O2/c1-3-10-21-20(24)16-13-18(19(23)15-7-5-4-6-8-15)22-11-9-14(2)12-17(16)22/h1,4-9,11-13H,10H2,2H3,(H,21,24)
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PubMed
n/an/a 1.53E+4n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using octyl-beta-D-glucopyranoside as substrate after 15 mins by fluorescence assay


Bioorg Med Chem Lett 24: 5777-81 (2014)


Article DOI: 10.1016/j.bmcl.2014.10.044
BindingDB Entry DOI: 10.7270/Q2W95BTK
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50189296
PNG
(CHEMBL3827509)
Show SMILES COc1cc(\C=C\C(=O)c2cc(C(O)=O)c3c(C)cc(C)cn23)cc(OC)c1OC
Show InChI InChI=1S/C23H23NO6/c1-13-8-14(2)21-16(23(26)27)11-17(24(21)12-13)18(25)7-6-15-9-19(28-3)22(30-5)20(10-15)29-4/h6-12H,1-5H3,(H,26,27)/b7-6+
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n/an/a 1.59E+4n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using farnesylpyrophosphate and dansyl-GCVLS as substrate measured for 15 mins by fluorescence as...


Bioorg Med Chem Lett 26: 3730-4 (2016)


Article DOI: 10.1016/j.bmcl.2016.05.074
BindingDB Entry DOI: 10.7270/Q2DR2XFP
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50498786
PNG
(CHEMBL3623723)
Show SMILES CSCC[C@H](NC(=O)CCN1c2ccccc2Sc2ccc(Cl)cc12)C(O)=O
Show InChI InChI=1S/C20H21ClN2O3S2/c1-27-11-9-14(20(25)26)22-19(24)8-10-23-15-4-2-3-5-17(15)28-18-7-6-13(21)12-16(18)23/h2-7,12,14H,8-11H2,1H3,(H,22,24)(H,25,26)/t14-/m0/s1
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n/an/a 1.89E+4n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human FTase using FPP/dansyl-GCVLS as substrate measured for 15 mins by fluorimetric analysis


Bioorg Med Chem Lett 25: 4447-52 (2015)

More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50189298
PNG
(CHEMBL3826985)
Show SMILES CCOC(=O)c1cc(C(=O)\C=C\c2cc(OC)c(OC)c(OC)c2)n2ccccc12
Show InChI InChI=1S/C23H23NO6/c1-5-30-23(26)16-14-18(24-11-7-6-8-17(16)24)19(25)10-9-15-12-20(27-2)22(29-4)21(13-15)28-3/h6-14H,5H2,1-4H3/b10-9+
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PubMed
n/an/a 1.93E+4n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using farnesylpyrophosphate and dansyl-GCVLS as substrate measured for 15 mins by fluorescence as...


Bioorg Med Chem Lett 26: 3730-4 (2016)


Article DOI: 10.1016/j.bmcl.2016.05.074
BindingDB Entry DOI: 10.7270/Q2DR2XFP
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50035923
PNG
(CHEMBL3361068)
Show SMILES OC(=O)c1cc(C(=O)c2ccc(Br)cc2)n2ccccc12
Show InChI InChI=1S/C16H10BrNO3/c17-11-6-4-10(5-7-11)15(19)14-9-12(16(20)21)13-3-1-2-8-18(13)14/h1-9H,(H,20,21)
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n/an/a 1.94E+4n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using octyl-beta-D-glucopyranoside as substrate after 15 mins by fluorescence assay


Bioorg Med Chem Lett 24: 5777-81 (2014)


Article DOI: 10.1016/j.bmcl.2014.10.044
BindingDB Entry DOI: 10.7270/Q2W95BTK
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50035925
PNG
(CHEMBL3361066)
Show SMILES OC(=O)c1cc(C(=O)c2ccccc2)n2ccccc12
Show InChI InChI=1S/C16H11NO3/c18-15(11-6-2-1-3-7-11)14-10-12(16(19)20)13-8-4-5-9-17(13)14/h1-10H,(H,19,20)
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PubMed
n/an/a 1.97E+4n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using octyl-beta-D-glucopyranoside as substrate after 15 mins by fluorescence assay


Bioorg Med Chem Lett 24: 5777-81 (2014)


Article DOI: 10.1016/j.bmcl.2014.10.044
BindingDB Entry DOI: 10.7270/Q2W95BTK
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50035924
PNG
(CHEMBL3361067)
Show SMILES OC(=O)c1cc(C(=O)c2ccc(Cl)cc2)n2ccccc12
Show InChI InChI=1S/C16H10ClNO3/c17-11-6-4-10(5-7-11)15(19)14-9-12(16(20)21)13-3-1-2-8-18(13)14/h1-9H,(H,20,21)
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PubMed
n/an/a 2.07E+4n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using octyl-beta-D-glucopyranoside as substrate after 15 mins by fluorescence assay


Bioorg Med Chem Lett 24: 5777-81 (2014)


Article DOI: 10.1016/j.bmcl.2014.10.044
BindingDB Entry DOI: 10.7270/Q2W95BTK
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50036273
PNG
(CHEMBL3361093)
Show SMILES Cc1cccc2c(cc(C(=O)c3ccc(Cl)cc3)n12)C(=O)OCCC#C
Show InChI InChI=1S/C21H16ClNO3/c1-3-4-12-26-21(25)17-13-19(23-14(2)6-5-7-18(17)23)20(24)15-8-10-16(22)11-9-15/h1,5-11,13H,4,12H2,2H3
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n/an/a 2.07E+4n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using octyl-beta-D-glucopyranoside as substrate after 15 mins by fluorescence assay


Bioorg Med Chem Lett 24: 5777-81 (2014)


Article DOI: 10.1016/j.bmcl.2014.10.044
BindingDB Entry DOI: 10.7270/Q2W95BTK
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50035930
PNG
(CHEMBL3361084)
Show SMILES Cc1cccc2c(cc(C(=O)c3ccccc3)n12)C(=O)OCC#C
Show InChI InChI=1S/C20H15NO3/c1-3-12-24-20(23)16-13-18(19(22)15-9-5-4-6-10-15)21-14(2)8-7-11-17(16)21/h1,4-11,13H,12H2,2H3
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n/an/a 2.08E+4n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using octyl-beta-D-glucopyranoside as substrate after 15 mins by fluorescence assay


Bioorg Med Chem Lett 24: 5777-81 (2014)


Article DOI: 10.1016/j.bmcl.2014.10.044
BindingDB Entry DOI: 10.7270/Q2W95BTK
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50036275
PNG
(CHEMBL3361075)
Show SMILES O=C(NCC#C)c1cc(C(=O)c2ccccc2)n2ccccc12
Show InChI InChI=1S/C19H14N2O2/c1-2-11-20-19(23)15-13-17(21-12-7-6-10-16(15)21)18(22)14-8-4-3-5-9-14/h1,3-10,12-13H,11H2,(H,20,23)
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n/an/a 2.21E+4n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using octyl-beta-D-glucopyranoside as substrate after 15 mins by fluorescence assay


Bioorg Med Chem Lett 24: 5777-81 (2014)


Article DOI: 10.1016/j.bmcl.2014.10.044
BindingDB Entry DOI: 10.7270/Q2W95BTK
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50035922
PNG
(CHEMBL3361070)
Show SMILES Cc1cccc2c(cc(C(=O)c3ccc(Cl)cc3)n12)C(O)=O
Show InChI InChI=1S/C17H12ClNO3/c1-10-3-2-4-14-13(17(21)22)9-15(19(10)14)16(20)11-5-7-12(18)8-6-11/h2-9H,1H3,(H,21,22)
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n/an/a 3.22E+4n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using octyl-beta-D-glucopyranoside as substrate after 15 mins by fluorescence assay


Bioorg Med Chem Lett 24: 5777-81 (2014)


Article DOI: 10.1016/j.bmcl.2014.10.044
BindingDB Entry DOI: 10.7270/Q2W95BTK
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50498785
PNG
(CHEMBL3623734)
Show SMILES SCCOC(=O)CCn1c2ccccc2c2ccccc12
Show InChI InChI=1S/C17H17NO2S/c19-17(20-11-12-21)9-10-18-15-7-3-1-5-13(15)14-6-2-4-8-16(14)18/h1-8,21H,9-12H2
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n/an/a 3.50E+4n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human FTase


Bioorg Med Chem Lett 25: 4447-52 (2015)

More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50498788
PNG
(CHEMBL3623717)
Show SMILES CSCC[C@H](NC(=O)CCn1c2ccccc2c2ccccc12)C(O)=O
Show InChI InChI=1S/C20H22N2O3S/c1-26-13-11-16(20(24)25)21-19(23)10-12-22-17-8-4-2-6-14(17)15-7-3-5-9-18(15)22/h2-9,16H,10-13H2,1H3,(H,21,23)(H,24,25)/t16-/m0/s1
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n/an/a 4.02E+4n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human FTase using FPP/dansyl-GCVLS as substrate measured for 15 mins by fluorimetric analysis


Bioorg Med Chem Lett 25: 4447-52 (2015)

More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50498790
PNG
(CHEMBL3623722)
Show SMILES CC(C)[C@H](NC(=O)CCN1c2ccccc2Sc2ccccc12)C(O)=O
Show InChI InChI=1S/C20H22N2O3S/c1-13(2)19(20(24)25)21-18(23)11-12-22-14-7-3-5-9-16(14)26-17-10-6-4-8-15(17)22/h3-10,13,19H,11-12H2,1-2H3,(H,21,23)(H,24,25)/t19-/m0/s1
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n/an/a 4.47E+4n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human FTase using FPP/dansyl-GCVLS as substrate measured for 15 mins by fluorimetric analysis


Bioorg Med Chem Lett 25: 4447-52 (2015)

More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50036278
PNG
(CHEMBL3361078)
Show SMILES Cc1cccc2c(cc(C(=O)c3ccccc3)n12)C(=O)NCC#C
Show InChI InChI=1S/C20H16N2O2/c1-3-12-21-20(24)16-13-18(19(23)15-9-5-4-6-10-15)22-14(2)8-7-11-17(16)22/h1,4-11,13H,12H2,2H3,(H,21,24)
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n/an/a 5.78E+4n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using octyl-beta-D-glucopyranoside as substrate after 15 mins by fluorescence assay


Bioorg Med Chem Lett 24: 5777-81 (2014)


Article DOI: 10.1016/j.bmcl.2014.10.044
BindingDB Entry DOI: 10.7270/Q2W95BTK
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50498789
PNG
(CHEMBL3623715)
Show SMILES OC(=O)[C@H](CS)NC(=O)CCn1c2ccccc2c2ccccc12
Show InChI InChI=1S/C18H18N2O3S/c21-17(19-14(11-24)18(22)23)9-10-20-15-7-3-1-5-12(15)13-6-2-4-8-16(13)20/h1-8,14,24H,9-11H2,(H,19,21)(H,22,23)/t14-/m0/s1
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n/an/a 6.54E+4n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human FTase using FPP/dansyl-GCVLS as substrate measured for 15 mins by fluorimetric analysis


Bioorg Med Chem Lett 25: 4447-52 (2015)

More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50036271
PNG
(CHEMBL3361072)
Show SMILES Cc1ccn2c(cc(C(O)=O)c2c1)C(=O)c1ccccc1
Show InChI InChI=1S/C17H13NO3/c1-11-7-8-18-14(9-11)13(17(20)21)10-15(18)16(19)12-5-3-2-4-6-12/h2-10H,1H3,(H,20,21)
PDB
MMDB

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PubMed
n/an/a 7.23E+4n/an/an/an/an/an/a



Alexandru Ioan Cuza University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using octyl-beta-D-glucopyranoside as substrate after 15 mins by fluorescence assay


Bioorg Med Chem Lett 24: 5777-81 (2014)


Article DOI: 10.1016/j.bmcl.2014.10.044
BindingDB Entry DOI: 10.7270/Q2W95BTK
More data for this
Ligand-Target Pair