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Compile Data Set for Download or QSAR

Found 187 hits with Last Name = 'rane' and Initial = 'df'   
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
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50495899
PNG
(CHEMBL3115256)
Show SMILES Cn1cncc1[C@@](C)(O)C1=Cc2cccnc2[C@@H](N2CCN(CC2)C(=O)NC2CCCCC2)c2ccc(Cl)cc12 |r,t:10|
Show InChI InChI=1S/C31H37ClN6O2/c1-31(40,27-19-33-20-36(27)2)26-17-21-7-6-12-34-28(21)29(24-11-10-22(32)18-25(24)26)37-13-15-38(16-14-37)30(39)35-23-8-4-3-5-9-23/h6-7,10-12,17-20,23,29,40H,3-5,8-9,13-16H2,1-2H3,(H,35,39)/t29-,31-/m0/s1
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n/an/a 0.100n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of FTase (unknown origin) assessed as transfer of [H3]farnesyl from [H3]farnesyl pyrophosphate to trichloroacetic acid-precipitable HaRas-...


Bioorg Med Chem Lett 24: 1228-31 (2014)


Article DOI: 10.1016/j.bmcl.2013.12.046
BindingDB Entry DOI: 10.7270/Q26H4MCJ
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50495912
PNG
(CHEMBL3115255)
Show SMILES Cn1cncc1[C@@](C)(O)C1=Cc2cccnc2[C@@H](N2CCN(CC2)C(N)=O)c2ccc(Cl)cc12 |r,t:10|
Show InChI InChI=1S/C25H27ClN6O2/c1-25(34,21-14-28-15-30(21)2)20-12-16-4-3-7-29-22(16)23(18-6-5-17(26)13-19(18)20)31-8-10-32(11-9-31)24(27)33/h3-7,12-15,23,34H,8-11H2,1-2H3,(H2,27,33)/t23-,25-/m0/s1
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n/an/a 0.100n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of FTase (unknown origin) assessed as transfer of [H3]farnesyl from [H3]farnesyl pyrophosphate to trichloroacetic acid-precipitable HaRas-...


Bioorg Med Chem Lett 24: 1228-31 (2014)


Article DOI: 10.1016/j.bmcl.2013.12.046
BindingDB Entry DOI: 10.7270/Q26H4MCJ
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50495906
PNG
(CHEMBL3115258)
Show SMILES CC(C)OC(=O)N1CCN(CC1)[C@H]1c2ccc(Cl)cc2C(=Cc2cccnc12)[C@](C)(O)c1cncn1C |r,c:22|
Show InChI InChI=1S/C28H32ClN5O3/c1-18(2)37-27(35)34-12-10-33(11-13-34)26-21-8-7-20(29)15-22(21)23(14-19-6-5-9-31-25(19)26)28(3,36)24-16-30-17-32(24)4/h5-9,14-18,26,36H,10-13H2,1-4H3/t26-,28-/m0/s1
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n/an/a 0.200n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of FTase (unknown origin) assessed as transfer of [H3]farnesyl from [H3]farnesyl pyrophosphate to trichloroacetic acid-precipitable HaRas-...


Bioorg Med Chem Lett 24: 1228-31 (2014)


Article DOI: 10.1016/j.bmcl.2013.12.046
BindingDB Entry DOI: 10.7270/Q26H4MCJ
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50495911
PNG
(CHEMBL601202)
Show SMILES Cn1cncc1[C@H](O)C1=Cc2cccnc2[C@@H](N2CCN(CC2)C(=O)OC(C)(C)C)c2ccc(Cl)cc12 |r,t:9|
Show InChI InChI=1S/C28H32ClN5O3/c1-28(2,3)37-27(36)34-12-10-33(11-13-34)25-20-8-7-19(29)15-21(20)22(14-18-6-5-9-31-24(18)25)26(35)23-16-30-17-32(23)4/h5-9,14-17,25-26,35H,10-13H2,1-4H3/t25-,26+/m0/s1
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n/an/a 0.300n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of FTase (unknown origin) assessed as transfer of [H3]farnesyl from [H3]farnesyl pyrophosphate to trichloroacetic acid-precipitable HaRas-...


Bioorg Med Chem Lett 24: 1228-31 (2014)


Article DOI: 10.1016/j.bmcl.2013.12.046
BindingDB Entry DOI: 10.7270/Q26H4MCJ
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50495918
PNG
(CHEMBL3115265)
Show SMILES Cn1cncc1[C@](C)(O)C1=Cc2cccnc2[C@@H](N2CCN(CC2)C(=O)NC2CCCCC2)c2ccc(Cl)cc12 |r,t:10|
Show InChI InChI=1S/C31H37ClN6O2/c1-31(40,27-19-33-20-36(27)2)26-17-21-7-6-12-34-28(21)29(24-11-10-22(32)18-25(24)26)37-13-15-38(16-14-37)30(39)35-23-8-4-3-5-9-23/h6-7,10-12,17-20,23,29,40H,3-5,8-9,13-16H2,1-2H3,(H,35,39)/t29-,31+/m0/s1
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n/an/a 0.400n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of FTase (unknown origin) assessed as transfer of [H3]farnesyl from [H3]farnesyl pyrophosphate to trichloroacetic acid-precipitable HaRas-...


Bioorg Med Chem Lett 24: 1228-31 (2014)


Article DOI: 10.1016/j.bmcl.2013.12.046
BindingDB Entry DOI: 10.7270/Q26H4MCJ
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50495902
PNG
(CHEMBL3115429)
Show SMILES Cn1cncc1[C@](C)(O)C1=Cc2cccnc2[C@@H](N2CCN(CC2)C(=O)OC2CCCC2)c2ccc(Cl)cc12 |r,t:10|
Show InChI InChI=1S/C30H34ClN5O3/c1-30(38,26-18-32-19-34(26)2)25-16-20-6-5-11-33-27(20)28(23-10-9-21(31)17-24(23)25)35-12-14-36(15-13-35)29(37)39-22-7-3-4-8-22/h5-6,9-11,16-19,22,28,38H,3-4,7-8,12-15H2,1-2H3/t28-,30+/m0/s1
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n/an/a 0.600n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of FTase (unknown origin) assessed as transfer of [H3]farnesyl from [H3]farnesyl pyrophosphate to trichloroacetic acid-precipitable HaRas-...


Bioorg Med Chem Lett 24: 1228-31 (2014)


Article DOI: 10.1016/j.bmcl.2013.12.046
BindingDB Entry DOI: 10.7270/Q26H4MCJ
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50495905
PNG
(CHEMBL3115426)
Show SMILES CC(C)OC(=O)N1CCN(CC1)[C@H]1c2ccc(Cl)cc2C(=Cc2cccnc12)[C@@](C)(O)c1cncn1C |r,c:22|
Show InChI InChI=1S/C28H32ClN5O3/c1-18(2)37-27(35)34-12-10-33(11-13-34)26-21-8-7-20(29)15-22(21)23(14-19-6-5-9-31-25(19)26)28(3,36)24-16-30-17-32(24)4/h5-9,14-18,26,36H,10-13H2,1-4H3/t26-,28+/m0/s1
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n/an/a 0.600n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of FTase (unknown origin) assessed as transfer of [H3]farnesyl from [H3]farnesyl pyrophosphate to trichloroacetic acid-precipitable HaRas-...


Bioorg Med Chem Lett 24: 1228-31 (2014)


Article DOI: 10.1016/j.bmcl.2013.12.046
BindingDB Entry DOI: 10.7270/Q26H4MCJ
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50495913
PNG
(CHEMBL3115261)
Show SMILES Cn1cncc1[C@@](C)(O)C1=Cc2cccnc2[C@@H](N2CCN(CC2)C(=O)OC2CCCC2)c2ccc(Cl)cc12 |r,t:10|
Show InChI InChI=1S/C30H34ClN5O3/c1-30(38,26-18-32-19-34(26)2)25-16-20-6-5-11-33-27(20)28(23-10-9-21(31)17-24(23)25)35-12-14-36(15-13-35)29(37)39-22-7-3-4-8-22/h5-6,9-11,16-19,22,28,38H,3-4,7-8,12-15H2,1-2H3/t28-,30-/m0/s1
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n/an/a 0.600n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of FTase (unknown origin) assessed as transfer of [H3]farnesyl from [H3]farnesyl pyrophosphate to trichloroacetic acid-precipitable HaRas-...


Bioorg Med Chem Lett 24: 1228-31 (2014)


Article DOI: 10.1016/j.bmcl.2013.12.046
BindingDB Entry DOI: 10.7270/Q26H4MCJ
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50495907
PNG
(CHEMBL3115266)
Show SMILES Cn1cncc1[C@](C)(O)C1=Cc2cccnc2[C@@H](N2CCN(CC2)C(=O)NC(C)(C)C)c2ccc(Cl)cc12 |r,t:10|
Show InChI InChI=1S/C29H35ClN6O2/c1-28(2,3)33-27(37)36-13-11-35(12-14-36)26-21-9-8-20(30)16-22(21)23(15-19-7-6-10-32-25(19)26)29(4,38)24-17-31-18-34(24)5/h6-10,15-18,26,38H,11-14H2,1-5H3,(H,33,37)/t26-,29+/m0/s1
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n/an/a 0.700n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of FTase (unknown origin) assessed as transfer of [H3]farnesyl from [H3]farnesyl pyrophosphate to trichloroacetic acid-precipitable HaRas-...


Bioorg Med Chem Lett 24: 1228-31 (2014)


Article DOI: 10.1016/j.bmcl.2013.12.046
BindingDB Entry DOI: 10.7270/Q26H4MCJ
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50495922
PNG
(CHEMBL3115254)
Show SMILES Cn1cncc1[C@@](C)(O)C1=Cc2cccnc2[C@@H](N2CCN(CC2)C(=O)Nc2ccc(cc2)C#N)c2ccc(Cl)cc12 |r,t:10|
Show InChI InChI=1S/C32H30ClN7O2/c1-32(42,28-19-35-20-38(28)2)27-16-22-4-3-11-36-29(22)30(25-10-7-23(33)17-26(25)27)39-12-14-40(15-13-39)31(41)37-24-8-5-21(18-34)6-9-24/h3-11,16-17,19-20,30,42H,12-15H2,1-2H3,(H,37,41)/t30-,32-/m0/s1
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n/an/a 0.800n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of FTase (unknown origin) assessed as transfer of [H3]farnesyl from [H3]farnesyl pyrophosphate to trichloroacetic acid-precipitable HaRas-...


Bioorg Med Chem Lett 24: 1228-31 (2014)


Article DOI: 10.1016/j.bmcl.2013.12.046
BindingDB Entry DOI: 10.7270/Q26H4MCJ
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50495917
PNG
(CHEMBL3115257)
Show SMILES Cn1cncc1[C@@](C)(O)C1=Cc2cccnc2[C@@H](N2CCN(CC2)C(=O)NC(C)(C)C)c2ccc(Cl)cc12 |r,t:10|
Show InChI InChI=1S/C29H35ClN6O2/c1-28(2,3)33-27(37)36-13-11-35(12-14-36)26-21-9-8-20(30)16-22(21)23(15-19-7-6-10-32-25(19)26)29(4,38)24-17-31-18-34(24)5/h6-10,15-18,26,38H,11-14H2,1-5H3,(H,33,37)/t26-,29-/m0/s1
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n/an/a 0.900n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of FTase (unknown origin) assessed as transfer of [H3]farnesyl from [H3]farnesyl pyrophosphate to trichloroacetic acid-precipitable HaRas-...


Bioorg Med Chem Lett 24: 1228-31 (2014)


Article DOI: 10.1016/j.bmcl.2013.12.046
BindingDB Entry DOI: 10.7270/Q26H4MCJ
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM14457
PNG
((+)-4-(8-Chloro-3,10-dibromo-6,11-dihydro-5H-benzo...)
Show SMILES [O-][n+]1ccc(CC(=O)N2CCC(CC2)[C@H]2c3ncc(Br)cc3CCc3cc(Cl)cc(Br)c23)cc1 |r|
Show InChI InChI=1S/C26H24Br2ClN3O2/c27-20-12-19-2-1-18-13-21(29)14-22(28)24(18)25(26(19)30-15-20)17-5-7-31(8-6-17)23(33)11-16-3-9-32(34)10-4-16/h3-4,9-10,12-15,17,25H,1-2,5-8,11H2/t25-/m1/s1
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Article
PubMed
n/an/a 1.30n/an/an/an/a7.522



Schering-Plough Research Institute



Assay Description
FPT activity was determined by measuring transfer of [3H] farnesyl from [3H]farnesyl pyrophosphate to the substrate His6-Ha-Ras-CVLS. The incorporate...


J Med Chem 41: 4890-902 (1998)


Article DOI: 10.1021/jm980462b
BindingDB Entry DOI: 10.7270/Q2ZS2TRS
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50495901
PNG
(CHEMBL3115253)
Show SMILES Cn1cncc1[C@@](C)(O)C1=Cc2cccnc2[C@@H](N2CCN(CC2)C(=O)OC(C)(C)C)c2ccc(Cl)cc12 |r,t:10|
Show InChI InChI=1S/C29H34ClN5O3/c1-28(2,3)38-27(36)35-13-11-34(12-14-35)26-21-9-8-20(30)16-22(21)23(15-19-7-6-10-32-25(19)26)29(4,37)24-17-31-18-33(24)5/h6-10,15-18,26,37H,11-14H2,1-5H3/t26-,29-/m0/s1
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n/an/a 1.40n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of FTase (unknown origin) assessed as transfer of [H3]farnesyl from [H3]farnesyl pyrophosphate to trichloroacetic acid-precipitable HaRas-...


Bioorg Med Chem Lett 24: 1228-31 (2014)


Article DOI: 10.1016/j.bmcl.2013.12.046
BindingDB Entry DOI: 10.7270/Q26H4MCJ
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50495904
PNG
(CHEMBL3115427)
Show SMILES Cn1cncc1[C@](C)(O)C1=Cc2cccnc2[C@@H](N2CCN(CC2)C(=O)OC2CCCCC2)c2ccc(Cl)cc12 |r,t:10|
Show InChI InChI=1S/C31H36ClN5O3/c1-31(39,27-19-33-20-35(27)2)26-17-21-7-6-12-34-28(21)29(24-11-10-22(32)18-25(24)26)36-13-15-37(16-14-36)30(38)40-23-8-4-3-5-9-23/h6-7,10-12,17-20,23,29,39H,3-5,8-9,13-16H2,1-2H3/t29-,31+/m0/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of FTase (unknown origin) assessed as transfer of [H3]farnesyl from [H3]farnesyl pyrophosphate to trichloroacetic acid-precipitable HaRas-...


Bioorg Med Chem Lett 24: 1228-31 (2014)


Article DOI: 10.1016/j.bmcl.2013.12.046
BindingDB Entry DOI: 10.7270/Q26H4MCJ
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50495914
PNG
(CHEMBL3115259)
Show SMILES Cn1cncc1[C@@](C)(O)C1=Cc2cccnc2[C@@H](N2CCN(CC2)C(=O)OC2CCCCC2)c2ccc(Cl)cc12 |r,t:10|
Show InChI InChI=1S/C31H36ClN5O3/c1-31(39,27-19-33-20-35(27)2)26-17-21-7-6-12-34-28(21)29(24-11-10-22(32)18-25(24)26)36-13-15-37(16-14-36)30(38)40-23-8-4-3-5-9-23/h6-7,10-12,17-20,23,29,39H,3-5,8-9,13-16H2,1-2H3/t29-,31-/m0/s1
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n/an/a 1.70n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of FTase (unknown origin) assessed as transfer of [H3]farnesyl from [H3]farnesyl pyrophosphate to trichloroacetic acid-precipitable HaRas-...


Bioorg Med Chem Lett 24: 1228-31 (2014)


Article DOI: 10.1016/j.bmcl.2013.12.046
BindingDB Entry DOI: 10.7270/Q26H4MCJ
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50495920
PNG
(CHEMBL3115251)
Show SMILES Cn1cncc1C(C)(O)C1=Cc2cccnc2[C@@H](N2CCN(CC2)C(=O)OC(C)(C)C)c2ccc(Cl)cc12 |r,t:10|
Show InChI InChI=1S/C29H34ClN5O3/c1-28(2,3)38-27(36)35-13-11-34(12-14-35)26-21-9-8-20(30)16-22(21)23(15-19-7-6-10-32-25(19)26)29(4,37)24-17-31-18-33(24)5/h6-10,15-18,26,37H,11-14H2,1-5H3/t26-,29?/m0/s1
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n/an/a 1.80n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of FTase (unknown origin) assessed as transfer of [H3]farnesyl from [H3]farnesyl pyrophosphate to trichloroacetic acid-precipitable HaRas-...


Bioorg Med Chem Lett 24: 1228-31 (2014)


Article DOI: 10.1016/j.bmcl.2013.12.046
BindingDB Entry DOI: 10.7270/Q26H4MCJ
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM14461
PNG
((+)-4-(3,10-Dibromo-8-chloro-6,11-dihydro-5H-benzo...)
Show SMILES [O-][n+]1ccc(CC(=O)N2CCN(CC2)[C@H]2c3ncc(Br)cc3CCc3cc(Cl)cc(Br)c23)cc1 |r|
Show InChI InChI=1S/C25H23Br2ClN4O2/c26-19-12-18-2-1-17-13-20(28)14-21(27)23(17)25(24(18)29-15-19)31-9-7-30(8-10-31)22(33)11-16-3-5-32(34)6-4-16/h3-6,12-15,25H,1-2,7-11H2/t25-/m1/s1
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n/an/a 1.80n/an/an/an/a7.522



Schering-Plough Research Institute



Assay Description
FPT activity was determined by measuring transfer of [3H] farnesyl from [3H]farnesyl pyrophosphate to the substrate His6-Ha-Ras-CVLS. The incorporate...


J Med Chem 41: 4890-902 (1998)


Article DOI: 10.1021/jm980462b
BindingDB Entry DOI: 10.7270/Q2ZS2TRS
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50495900
PNG
(CHEMBL3115263)
Show SMILES Cn1cncc1[C@](C)(O)C1=Cc2cccnc2[C@@H](N2CCN(CC2)C(=O)Nc2ccc(cc2)C#N)c2ccc(Cl)cc12 |r,t:10|
Show InChI InChI=1S/C32H30ClN7O2/c1-32(42,28-19-35-20-38(28)2)27-16-22-4-3-11-36-29(22)30(25-10-7-23(33)17-26(25)27)39-12-14-40(15-13-39)31(41)37-24-8-5-21(18-34)6-9-24/h3-11,16-17,19-20,30,42H,12-15H2,1-2H3,(H,37,41)/t30-,32+/m0/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of FTase (unknown origin) assessed as transfer of [H3]farnesyl from [H3]farnesyl pyrophosphate to trichloroacetic acid-precipitable HaRas-...


Bioorg Med Chem Lett 24: 1228-31 (2014)


Article DOI: 10.1016/j.bmcl.2013.12.046
BindingDB Entry DOI: 10.7270/Q26H4MCJ
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50495909
PNG
(CHEMBL3115248)
Show SMILES [H][C@]12C[C@]1(c1cc(Cl)ccc1[C@H](N1CCN(CC1)C(=O)OC(C)(C)C)c1ncccc21)C(C)(O)c1cncn1C |r|
Show InChI InChI=1S/C30H36ClN5O3/c1-28(2,3)39-27(37)36-13-11-35(12-14-36)26-21-9-8-19(31)15-22(21)30(29(4,38)24-17-32-18-34(24)5)16-23(30)20-7-6-10-33-25(20)26/h6-10,15,17-18,23,26,38H,11-14,16H2,1-5H3/t23-,26+,29?,30-/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of FTase (unknown origin) assessed as transfer of [H3]farnesyl from [H3]farnesyl pyrophosphate to trichloroacetic acid-precipitable HaRas-...


Bioorg Med Chem Lett 24: 1228-31 (2014)


Article DOI: 10.1016/j.bmcl.2013.12.046
BindingDB Entry DOI: 10.7270/Q26H4MCJ
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM14459
PNG
((+)-4-[2-[4-(8-Chloro-3,10-dibromo-6,11-dihydro-5H...)
Show SMILES NC(=O)N1CCC(CC(=O)N2CCC(CC2)[C@H]2c3ncc(Br)cc3CCc3cc(Cl)cc(Br)c23)CC1 |r|
Show InChI InChI=1S/C27H31Br2ClN4O2/c28-20-12-19-2-1-18-13-21(30)14-22(29)24(18)25(26(19)32-15-20)17-5-9-33(10-6-17)23(35)11-16-3-7-34(8-4-16)27(31)36/h12-17,25H,1-11H2,(H2,31,36)/t25-/m1/s1
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n/an/a 1.90n/an/an/an/a7.522



Schering-Plough Research Institute



Assay Description
FPT activity was determined by measuring transfer of [3H] farnesyl from [3H]farnesyl pyrophosphate to the substrate His6-Ha-Ras-CVLS. The incorporate...


J Med Chem 41: 4890-902 (1998)


Article DOI: 10.1021/jm980462b
BindingDB Entry DOI: 10.7270/Q2ZS2TRS
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM14473
PNG
((-)-1-(8-Chloro-3,7-dibromo-6,11-dihydro-5H-benzo-...)
Show SMILES [O-][n+]1ccc(CC(=O)N2CCN(CC2)[C@H]2c3ccc(Cl)c(Br)c3CCc3cc(Br)cnc23)cc1 |r|
Show InChI InChI=1S/C25H23Br2ClN4O2/c26-18-14-17-1-2-19-20(3-4-21(28)23(19)27)25(24(17)29-15-18)31-11-9-30(10-12-31)22(33)13-16-5-7-32(34)8-6-16/h3-8,14-15,25H,1-2,9-13H2/t25-/m0/s1
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n/an/a 2.30n/an/an/an/a7.522



Schering-Plough Research Institute



Assay Description
FPT activity was determined by measuring transfer of [3H] farnesyl from [3H]farnesyl pyrophosphate to the substrate His6-Ha-Ras-CVLS. The incorporate...


J Med Chem 41: 4890-902 (1998)


Article DOI: 10.1021/jm980462b
BindingDB Entry DOI: 10.7270/Q2ZS2TRS
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM14467
PNG
((+)-4-[2-[4-(8-Chloro-3,10-dibromo-6,11-dihydro-5H...)
Show SMILES NC(=O)N1CCC(CC(=O)N2CCN(CC2)[C@H]2c3ncc(Br)cc3CCc3cc(Cl)cc(Br)c23)CC1 |r|
Show InChI InChI=1S/C26H30Br2ClN5O2/c27-19-12-18-2-1-17-13-20(29)14-21(28)23(17)25(24(18)31-15-19)33-9-7-32(8-10-33)22(35)11-16-3-5-34(6-4-16)26(30)36/h12-16,25H,1-11H2,(H2,30,36)/t25-/m1/s1
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n/an/a 2.5n/an/an/an/a7.522



Schering-Plough Research Institute



Assay Description
FPT activity was determined by measuring transfer of [3H] farnesyl from [3H]farnesyl pyrophosphate to the substrate His6-Ha-Ras-CVLS. The incorporate...


J Med Chem 41: 4890-902 (1998)


Article DOI: 10.1021/jm980462b
BindingDB Entry DOI: 10.7270/Q2ZS2TRS
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM14469
PNG
((-)-4-(8-Chloro-3,7-dibromo-6,11-dihydro-5H-benzo-...)
Show SMILES [O-][n+]1ccc(CC(=O)N2CCC(CC2)[C@H]2c3ccc(Cl)c(Br)c3CCc3cc(Br)cnc23)cc1 |r|
Show InChI InChI=1S/C26H24Br2ClN3O2/c27-19-14-18-1-2-21-20(3-4-22(29)25(21)28)24(26(18)30-15-19)17-7-9-31(10-8-17)23(33)13-16-5-11-32(34)12-6-16/h3-6,11-12,14-15,17,24H,1-2,7-10,13H2/t24-/m0/s1
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n/an/a 2.60n/an/an/an/a7.522



Schering-Plough Research Institute



Assay Description
FPT activity was determined by measuring transfer of [3H] farnesyl from [3H]farnesyl pyrophosphate to the substrate His6-Ha-Ras-CVLS. The incorporate...


J Med Chem 41: 4890-902 (1998)


Article DOI: 10.1021/jm980462b
BindingDB Entry DOI: 10.7270/Q2ZS2TRS
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50495919
PNG
(CHEMBL3115262)
Show SMILES Cn1cncc1[C@](C)(O)C1=Cc2cccnc2[C@@H](N2CCN(CC2)C(=O)OC(C)(C)C)c2ccc(Cl)cc12 |r,t:10|
Show InChI InChI=1S/C29H34ClN5O3/c1-28(2,3)38-27(36)35-13-11-34(12-14-35)26-21-9-8-20(30)16-22(21)23(15-19-7-6-10-32-25(19)26)29(4,37)24-17-31-18-33(24)5/h6-10,15-18,26,37H,11-14H2,1-5H3/t26-,29+/m0/s1
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n/an/a 2.60n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of FTase (unknown origin) assessed as transfer of [H3]farnesyl from [H3]farnesyl pyrophosphate to trichloroacetic acid-precipitable HaRas-...


Bioorg Med Chem Lett 24: 1228-31 (2014)


Article DOI: 10.1016/j.bmcl.2013.12.046
BindingDB Entry DOI: 10.7270/Q26H4MCJ
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM14477
PNG
((-)-4-[2-[4-(3,7-Dibromo-8-chloro-6,11-dihydro-5Hb...)
Show SMILES NC(=O)N1CCC(CC(=O)N2CCN(CC2)[C@H]2c3ccc(Cl)c(Br)c3CCc3cc(Br)cnc23)CC1 |r|
Show InChI InChI=1S/C26H30Br2ClN5O2/c27-18-14-17-1-2-19-20(3-4-21(29)23(19)28)25(24(17)31-15-18)33-11-9-32(10-12-33)22(35)13-16-5-7-34(8-6-16)26(30)36/h3-4,14-16,25H,1-2,5-13H2,(H2,30,36)/t25-/m0/s1
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n/an/a 3.10n/an/an/an/a7.522



Schering-Plough Research Institute



Assay Description
FPT activity was determined by measuring transfer of [3H] farnesyl from [3H]farnesyl pyrophosphate to the substrate His6-Ha-Ras-CVLS. The incorporate...


J Med Chem 41: 4890-902 (1998)


Article DOI: 10.1021/jm980462b
BindingDB Entry DOI: 10.7270/Q2ZS2TRS
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50495923
PNG
(CHEMBL3115430)
Show SMILES [H][C@]12C[C@@]1(C(=O)c1cncn1C)c1cc(Cl)ccc1[C@H](N1CCN(CC1)C(=O)OC(C)(C)C)c1ncccc21 |r|
Show InChI InChI=1S/C29H32ClN5O3/c1-28(2,3)38-27(37)35-12-10-34(11-13-35)25-20-8-7-18(30)14-21(20)29(26(36)23-16-31-17-33(23)4)15-22(29)19-6-5-9-32-24(19)25/h5-9,14,16-17,22,25H,10-13,15H2,1-4H3/t22-,25+,29-/m1/s1
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n/an/a 3.20n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of FTase (unknown origin) assessed as transfer of [H3]farnesyl from [H3]farnesyl pyrophosphate to trichloroacetic acid-precipitable HaRas-...


Bioorg Med Chem Lett 24: 1228-31 (2014)


Article DOI: 10.1016/j.bmcl.2013.12.046
BindingDB Entry DOI: 10.7270/Q26H4MCJ
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50495915
PNG
(CHEMBL3115431)
Show SMILES [H][C@@]12C[C@]1(C(=O)c1cncn1C)c1cc(Cl)ccc1[C@H](N1CCN(CC1)C(=O)OC(C)(C)C)c1ncccc21 |r|
Show InChI InChI=1S/C29H32ClN5O3/c1-28(2,3)38-27(37)35-12-10-34(11-13-35)25-20-8-7-18(30)14-21(20)29(26(36)23-16-31-17-33(23)4)15-22(29)19-6-5-9-32-24(19)25/h5-9,14,16-17,22,25H,10-13,15H2,1-4H3/t22-,25-,29-/m0/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of FTase (unknown origin) assessed as transfer of [H3]farnesyl from [H3]farnesyl pyrophosphate to trichloroacetic acid-precipitable HaRas-...


Bioorg Med Chem Lett 24: 1228-31 (2014)


Article DOI: 10.1016/j.bmcl.2013.12.046
BindingDB Entry DOI: 10.7270/Q26H4MCJ
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM14463
PNG
((+)-4-(3-Bromo-8,10-dichloro-6,11-dihydro-5H-benzo...)
Show SMILES [O-][n+]1ccc(CC(=O)N2CCN(CC2)[C@H]2c3ncc(Br)cc3CCc3cc(Cl)cc(Cl)c23)cc1 |r|
Show InChI InChI=1S/C25H23BrCl2N4O2/c26-19-12-18-2-1-17-13-20(27)14-21(28)23(17)25(24(18)29-15-19)31-9-7-30(8-10-31)22(33)11-16-3-5-32(34)6-4-16/h3-6,12-15,25H,1-2,7-11H2/t25-/m1/s1
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n/an/a<3.80n/an/an/an/a7.522



Schering-Plough Research Institute



Assay Description
FPT activity was determined by measuring transfer of [3H] farnesyl from [3H]farnesyl pyrophosphate to the substrate His6-Ha-Ras-CVLS. The incorporate...


J Med Chem 41: 4890-902 (1998)


Article DOI: 10.1021/jm980462b
BindingDB Entry DOI: 10.7270/Q2ZS2TRS
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM14471
PNG
((-)-4-[2-[4-(3,7-Dibromo-8-chloro-6,11-dihydro-5H-...)
Show SMILES NC(=O)N1CCC(CC(=O)N2CCC(CC2)[C@H]2c3ccc(Cl)c(Br)c3CCc3cc(Br)cnc23)CC1 |r|
Show InChI InChI=1S/C27H31Br2ClN4O2/c28-19-14-18-1-2-21-20(3-4-22(30)25(21)29)24(26(18)32-15-19)17-7-11-33(12-8-17)23(35)13-16-5-9-34(10-6-16)27(31)36/h3-4,14-17,24H,1-2,5-13H2,(H2,31,36)/t24-/m0/s1
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n/an/a 5n/an/an/an/a7.522



Schering-Plough Research Institute



Assay Description
FPT activity was determined by measuring transfer of [3H] farnesyl from [3H]farnesyl pyrophosphate to the substrate His6-Ha-Ras-CVLS. The incorporate...


J Med Chem 41: 4890-902 (1998)


Article DOI: 10.1021/jm980462b
BindingDB Entry DOI: 10.7270/Q2ZS2TRS
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50495921
PNG
(CHEMBL3115252)
Show SMILES CCC(O)(c1cncn1C)C1=Cc2cccnc2[C@@H](N2CCN(CC2)C(=O)OC(C)(C)C)c2ccc(Cl)cc12 |r,t:11|
Show InChI InChI=1S/C30H36ClN5O3/c1-6-30(38,25-18-32-19-34(25)5)24-16-20-8-7-11-33-26(20)27(22-10-9-21(31)17-23(22)24)35-12-14-36(15-13-35)28(37)39-29(2,3)4/h7-11,16-19,27,38H,6,12-15H2,1-5H3/t27-,30?/m0/s1
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n/an/a 5n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of FTase (unknown origin) assessed as transfer of [H3]farnesyl from [H3]farnesyl pyrophosphate to trichloroacetic acid-precipitable HaRas-...


Bioorg Med Chem Lett 24: 1228-31 (2014)


Article DOI: 10.1016/j.bmcl.2013.12.046
BindingDB Entry DOI: 10.7270/Q26H4MCJ
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50495903
PNG
(CHEMBL3115260)
Show SMILES Cn1cncc1[C@@](C)(O)C1=Cc2cccnc2[C@@H](N2CCN(CC2)C(=O)OC2(C)CCCCC2)c2ccc(Cl)cc12 |r,t:10|
Show InChI InChI=1S/C32H38ClN5O3/c1-31(11-5-4-6-12-31)41-30(39)38-16-14-37(15-17-38)29-24-10-9-23(33)19-25(24)26(18-22-8-7-13-35-28(22)29)32(2,40)27-20-34-21-36(27)3/h7-10,13,18-21,29,40H,4-6,11-12,14-17H2,1-3H3/t29-,32-/m0/s1
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n/an/a 5.5n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of FTase (unknown origin) assessed as transfer of [H3]farnesyl from [H3]farnesyl pyrophosphate to trichloroacetic acid-precipitable HaRas-...


Bioorg Med Chem Lett 24: 1228-31 (2014)


Article DOI: 10.1016/j.bmcl.2013.12.046
BindingDB Entry DOI: 10.7270/Q26H4MCJ
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM14475
PNG
((-)-1-(3-Bromo-7,8-dichloro-6,11-dihydro-5H-benzo-...)
Show SMILES [O-][n+]1ccc(CC(=O)N2CCN(CC2)[C@H]2c3ccc(Cl)c(Cl)c3CCc3cc(Br)cnc23)cc1 |r|
Show InChI InChI=1S/C25H23BrCl2N4O2/c26-18-14-17-1-2-19-20(3-4-21(27)23(19)28)25(24(17)29-15-18)31-11-9-30(10-12-31)22(33)13-16-5-7-32(34)8-6-16/h3-8,14-15,25H,1-2,9-13H2/t25-/m0/s1
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PubMed
n/an/a 6n/an/an/an/a7.522



Schering-Plough Research Institute



Assay Description
FPT activity was determined by measuring transfer of [3H] farnesyl from [3H]farnesyl pyrophosphate to the substrate His6-Ha-Ras-CVLS. The incorporate...


J Med Chem 41: 4890-902 (1998)


Article DOI: 10.1021/jm980462b
BindingDB Entry DOI: 10.7270/Q2ZS2TRS
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50495910
PNG
(CHEMBL603067)
Show SMILES Cn1cncc1[C@@H](O)C1=Cc2cccnc2[C@@H](N2CCN(CC2)C(=O)OC(C)(C)C)c2ccc(Cl)cc12 |r,t:9|
Show InChI InChI=1S/C28H32ClN5O3/c1-28(2,3)37-27(36)34-12-10-33(11-13-34)25-20-8-7-19(29)15-21(20)22(14-18-6-5-9-31-24(18)25)26(35)23-16-30-17-32(23)4/h5-9,14-17,25-26,35H,10-13H2,1-4H3/t25-,26-/m0/s1
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n/an/a 12n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of FTase (unknown origin) assessed as transfer of [H3]farnesyl from [H3]farnesyl pyrophosphate to trichloroacetic acid-precipitable HaRas-...


Bioorg Med Chem Lett 24: 1228-31 (2014)


Article DOI: 10.1016/j.bmcl.2013.12.046
BindingDB Entry DOI: 10.7270/Q26H4MCJ
More data for this
Ligand-Target Pair
Dimer of Protein farnesyltransferase subunit beta


(Homo sapiens (Human))
BDBM50061441
PNG
(1-[4-(8-Chloro-6,11-dihydro-5H-benzo[5,6]cyclohept...)
Show SMILES Clc1ccc2C(N3CCN(CC3)C(=O)Cc3ccncc3)c3ncccc3CCc2c1
Show InChI InChI=1S/C25H25ClN4O/c26-21-5-6-22-20(17-21)4-3-19-2-1-9-28-24(19)25(22)30-14-12-29(13-15-30)23(31)16-18-7-10-27-11-8-18/h1-2,5-11,17,25H,3-4,12-16H2
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PubMed
n/an/a 14n/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant human farnesyltransferase


J Med Chem 40: 4103-12 (1998)


Article DOI: 10.1021/jm970291v
BindingDB Entry DOI: 10.7270/Q2T152R0
More data for this
Ligand-Target Pair
Dimer of Protein farnesyltransferase subunit beta


(Homo sapiens (Human))
BDBM50061441
PNG
(1-[4-(8-Chloro-6,11-dihydro-5H-benzo[5,6]cyclohept...)
Show SMILES Clc1ccc2C(N3CCN(CC3)C(=O)Cc3ccncc3)c3ncccc3CCc2c1
Show InChI InChI=1S/C25H25ClN4O/c26-21-5-6-22-20(17-21)4-3-19-2-1-9-28-24(19)25(22)30-14-12-29(13-15-30)23(31)16-18-7-10-27-11-8-18/h1-2,5-11,17,25H,3-4,12-16H2
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n/an/a 14n/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant human farnesyltransferase


J Med Chem 40: 4103-12 (1998)


Article DOI: 10.1021/jm970291v
BindingDB Entry DOI: 10.7270/Q2T152R0
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM14465
PNG
((+)-4-(3-Bromo-8-chloro-10-fluoro-6,11-dihydro-5H-...)
Show SMILES [O-][n+]1ccc(CC(=O)N2CCN(CC2)[C@H]2c3ncc(Br)cc3CCc3cc(Cl)cc(F)c23)cc1 |r|
Show InChI InChI=1S/C25H23BrClFN4O2/c26-19-12-18-2-1-17-13-20(27)14-21(28)23(17)25(24(18)29-15-19)31-9-7-30(8-10-31)22(33)11-16-3-5-32(34)6-4-16/h3-6,12-15,25H,1-2,7-11H2/t25-/m1/s1
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n/an/a 16.7n/an/an/an/a7.522



Schering-Plough Research Institute



Assay Description
FPT activity was determined by measuring transfer of [3H] farnesyl from [3H]farnesyl pyrophosphate to the substrate His6-Ha-Ras-CVLS. The incorporate...


J Med Chem 41: 4890-902 (1998)


Article DOI: 10.1021/jm980462b
BindingDB Entry DOI: 10.7270/Q2ZS2TRS
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50495908
PNG
(CHEMBL3115249)
Show SMILES [H][C@@]12C[C@@]1(c1cc(Cl)ccc1[C@H](N1CCN(CC1)C(=O)OC(C)(C)C)c1ncccc21)C(C)(O)c1cncn1C |r|
Show InChI InChI=1S/C30H36ClN5O3/c1-28(2,3)39-27(37)36-13-11-35(12-14-36)26-21-9-8-19(31)15-22(21)30(29(4,38)24-17-32-18-34(24)5)16-23(30)20-7-6-10-33-25(20)26/h6-10,15,17-18,23,26,38H,11-14,16H2,1-5H3/t23-,26-,29?,30-/m0/s1
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n/an/a>18n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of FTase (unknown origin) assessed as transfer of [H3]farnesyl from [H3]farnesyl pyrophosphate to trichloroacetic acid-precipitable HaRas-...


Bioorg Med Chem Lett 24: 1228-31 (2014)


Article DOI: 10.1016/j.bmcl.2013.12.046
BindingDB Entry DOI: 10.7270/Q26H4MCJ
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50495916
PNG
(CHEMBL3115250)
Show SMILES Cn1cncc1C(=O)C1=Cc2cccnc2[C@@H](N2CCN(CC2)C(=O)OC(C)(C)C)c2ccc(Cl)cc12 |r,t:9|
Show InChI InChI=1S/C28H30ClN5O3/c1-28(2,3)37-27(36)34-12-10-33(11-13-34)25-20-8-7-19(29)15-21(20)22(14-18-6-5-9-31-24(18)25)26(35)23-16-30-17-32(23)4/h5-9,14-17,25H,10-13H2,1-4H3/t25-/m0/s1
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n/an/a>18n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of FTase (unknown origin) assessed as transfer of [H3]farnesyl from [H3]farnesyl pyrophosphate to trichloroacetic acid-precipitable HaRas-...


Bioorg Med Chem Lett 24: 1228-31 (2014)


Article DOI: 10.1016/j.bmcl.2013.12.046
BindingDB Entry DOI: 10.7270/Q26H4MCJ
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50495898
PNG
(CHEMBL3115264)
Show SMILES Cn1cncc1[C@](C)(O)C1=Cc2cccnc2[C@@H](N2CCN(CC2)C(N)=O)c2ccc(Cl)cc12 |r,t:10|
Show InChI InChI=1S/C25H27ClN6O2/c1-25(34,21-14-28-15-30(21)2)20-12-16-4-3-7-29-22(16)23(18-6-5-17(26)13-19(18)20)31-8-10-32(11-9-31)24(27)33/h3-7,12-15,23,34H,8-11H2,1-2H3,(H2,27,33)/t23-,25+/m0/s1
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n/an/a>20n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of FTase (unknown origin) assessed as transfer of [H3]farnesyl from [H3]farnesyl pyrophosphate to trichloroacetic acid-precipitable HaRas-...


Bioorg Med Chem Lett 24: 1228-31 (2014)


Article DOI: 10.1016/j.bmcl.2013.12.046
BindingDB Entry DOI: 10.7270/Q26H4MCJ
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM14466
PNG
((-)-4-(3-Bromo-8-chloro-10-fluoro-6,11-dihydro-5H-...)
Show SMILES [O-][n+]1ccc(CC(=O)N2CCN(CC2)[C@@H]2c3ncc(Br)cc3CCc3cc(Cl)cc(F)c23)cc1 |r|
Show InChI InChI=1S/C25H23BrClFN4O2/c26-19-12-18-2-1-17-13-20(27)14-21(28)23(17)25(24(18)29-15-19)31-9-7-30(8-10-31)22(33)11-16-3-5-32(34)6-4-16/h3-6,12-15,25H,1-2,7-11H2/t25-/m0/s1
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PubMed
n/an/a 33.1n/an/an/an/a7.522



Schering-Plough Research Institute



Assay Description
FPT activity was determined by measuring transfer of [3H] farnesyl from [3H]farnesyl pyrophosphate to the substrate His6-Ha-Ras-CVLS. The incorporate...


J Med Chem 41: 4890-902 (1998)


Article DOI: 10.1021/jm980462b
BindingDB Entry DOI: 10.7270/Q2ZS2TRS
More data for this
Ligand-Target Pair
Dimer of Protein farnesyltransferase subunit beta


(Homo sapiens (Human))
BDBM50061469
PNG
(1-[4-(8-CHLORO-3-METHYL-5,6-DIHYDRO-BENZO[5,6]CYCL...)
Show SMILES [#6]-c1cnc2c(-[#6]-[#6]-c3cc(Cl)ccc3\[#6]-2=[#6]-2\[#6]-[#6]-[#7](-[#6]-[#6]-2)-[#6](=O)-[#6]-c2ccncc2)c1
Show InChI InChI=1S/C27H26ClN3O/c1-18-14-22-3-2-21-16-23(28)4-5-24(21)26(27(22)30-17-18)20-8-12-31(13-9-20)25(32)15-19-6-10-29-11-7-19/h4-7,10-11,14,16-17H,2-3,8-9,12-13,15H2,1H3
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n/an/a 40n/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of Farnesyltransferase


J Med Chem 40: 4290-301 (1998)


Article DOI: 10.1021/jm970464g
BindingDB Entry DOI: 10.7270/Q2NC60B2
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM14456
PNG
(4-N-carboxamidopiperidinylacetyl 2 | 4-[2-(4-{6-br...)
Show SMILES NC(=O)N1CCC(CC(=O)N2CCN(CC2)C2c3ccc(Cl)cc3CCc3cc(Br)cnc23)CC1
Show InChI InChI=1S/C26H31BrClN5O2/c27-20-14-19-2-1-18-15-21(28)3-4-22(18)25(24(19)30-16-20)32-11-9-31(10-12-32)23(34)13-17-5-7-33(8-6-17)26(29)35/h3-4,14-17,25H,1-2,5-13H2,(H2,29,35)
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PubMed
n/an/a 49n/an/an/an/a7.522



Schering-Plough Research Institute



Assay Description
FPT activity was determined by measuring transfer of [3H] farnesyl from [3H]farnesyl pyrophosphate to the substrate His6-Ha-Ras-CVLS. The incorporate...


J Med Chem 41: 4890-902 (1998)


Article DOI: 10.1021/jm980462b
BindingDB Entry DOI: 10.7270/Q2ZS2TRS
More data for this
Ligand-Target Pair
Dimer of Protein farnesyltransferase subunit beta


(Homo sapiens (Human))
BDBM50061819
PNG
(1-[4-(3-Bromo-8-chloro-5,6-dihydro-benzo[5,6]cyclo...)
Show SMILES Clc1ccc2c(-[#6]-[#6]-c3cc(Br)cnc3\[#6]-2=[#6]-2/[#6]-[#6]-[#7](-[#6]-[#6]-2)-[#6](=O)-[#6]-c2ccncc2)c1
Show InChI InChI=1S/C26H23BrClN3O/c27-21-14-20-2-1-19-15-22(28)3-4-23(19)25(26(20)30-16-21)18-7-11-31(12-8-18)24(32)13-17-5-9-29-10-6-17/h3-6,9-10,14-16H,1-2,7-8,11-13H2
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n/an/a 60n/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of Farnesyltransferase


J Med Chem 40: 4290-301 (1998)


Article DOI: 10.1021/jm970464g
BindingDB Entry DOI: 10.7270/Q2NC60B2
More data for this
Ligand-Target Pair
Dimer of Protein farnesyltransferase subunit beta


(Homo sapiens (Human))
BDBM50061469
PNG
(1-[4-(8-CHLORO-3-METHYL-5,6-DIHYDRO-BENZO[5,6]CYCL...)
Show SMILES [#6]-c1cnc2c(-[#6]-[#6]-c3cc(Cl)ccc3\[#6]-2=[#6]-2\[#6]-[#6]-[#7](-[#6]-[#6]-2)-[#6](=O)-[#6]-c2ccncc2)c1
Show InChI InChI=1S/C27H26ClN3O/c1-18-14-22-3-2-21-16-23(28)4-5-24(21)26(27(22)30-17-18)20-8-12-31(13-9-20)25(32)15-19-6-10-29-11-7-19/h4-7,10-11,14,16-17H,2-3,8-9,12-13,15H2,1H3
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n/an/a 60n/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant human farnesyltransferase


J Med Chem 40: 4103-12 (1998)


Article DOI: 10.1021/jm970291v
BindingDB Entry DOI: 10.7270/Q2T152R0
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM14470
PNG
((+)-4-(8-Chloro-3,7-dibromo-6,11-dihydro-5H-benzo-...)
Show SMILES [O-][n+]1ccc(CC(=O)N2CCC(CC2)[C@@H]2c3ccc(Cl)c(Br)c3CCc3cc(Br)cnc23)cc1 |r|
Show InChI InChI=1S/C26H24Br2ClN3O2/c27-19-14-18-1-2-21-20(3-4-22(29)25(21)28)24(26(18)30-15-19)17-7-9-31(10-8-17)23(33)13-16-5-11-32(34)12-6-16/h3-6,11-12,14-15,17,24H,1-2,7-10,13H2/t24-/m1/s1
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n/an/a 62n/an/an/an/a7.522



Schering-Plough Research Institute



Assay Description
FPT activity was determined by measuring transfer of [3H] farnesyl from [3H]farnesyl pyrophosphate to the substrate His6-Ha-Ras-CVLS. The incorporate...


J Med Chem 41: 4890-902 (1998)


Article DOI: 10.1021/jm980462b
BindingDB Entry DOI: 10.7270/Q2ZS2TRS
More data for this
Ligand-Target Pair
Dimer of Protein farnesyltransferase subunit beta


(Homo sapiens (Human))
BDBM50061811
PNG
(1-[4-(8-Chloro-3-iodo-5,6-dihydro-benzo[5,6]cycloh...)
Show SMILES Clc1ccc2c(-[#6]-[#6]-c3cc(I)cnc3\[#6]-2=[#6]-2/[#6]-[#6]-[#7](-[#6]-[#6]-2)-[#6](=O)-[#6]-c2ccncc2)c1
Show InChI InChI=1S/C26H23ClIN3O/c27-21-3-4-23-19(14-21)1-2-20-15-22(28)16-30-26(20)25(23)18-7-11-31(12-8-18)24(32)13-17-5-9-29-10-6-17/h3-6,9-10,14-16H,1-2,7-8,11-13H2
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n/an/a 68n/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of Farnesyltransferase


J Med Chem 40: 4290-301 (1998)


Article DOI: 10.1021/jm970464g
BindingDB Entry DOI: 10.7270/Q2NC60B2
More data for this
Ligand-Target Pair
Dimer of Protein farnesyltransferase subunit beta


(Homo sapiens (Human))
BDBM50061818
PNG
(1-[4-(3,8-Dichloro-5,6-dihydro-benzo[5,6]cyclohept...)
Show SMILES Clc1ccc2c(-[#6]-[#6]-c3cc(Cl)cnc3\[#6]-2=[#6]-2/[#6]-[#6]-[#7](-[#6]-[#6]-2)-[#6](=O)-[#6]-c2ccncc2)c1
Show InChI InChI=1S/C26H23Cl2N3O/c27-21-3-4-23-19(14-21)1-2-20-15-22(28)16-30-26(20)25(23)18-7-11-31(12-8-18)24(32)13-17-5-9-29-10-6-17/h3-6,9-10,14-16H,1-2,7-8,11-13H2
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n/an/a 72n/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of Farnesyltransferase


J Med Chem 40: 4290-301 (1998)


Article DOI: 10.1021/jm970464g
BindingDB Entry DOI: 10.7270/Q2NC60B2
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM14472
PNG
((+)-4-[2-[4-(3,7-Dibromo-8-chloro-6,11-dihydro-5H-...)
Show SMILES NC(=O)N1CCC(CC(=O)N2CCC(CC2)[C@@H]2c3ccc(Cl)c(Br)c3CCc3cc(Br)cnc23)CC1 |r|
Show InChI InChI=1S/C27H31Br2ClN4O2/c28-19-14-18-1-2-21-20(3-4-22(30)25(21)29)24(26(18)32-15-19)17-7-11-33(12-8-17)23(35)13-16-5-9-34(10-6-16)27(31)36/h3-4,14-17,24H,1-2,5-13H2,(H2,31,36)/t24-/m1/s1
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n/an/a 78n/an/an/an/a7.522



Schering-Plough Research Institute



Assay Description
FPT activity was determined by measuring transfer of [3H] farnesyl from [3H]farnesyl pyrophosphate to the substrate His6-Ha-Ras-CVLS. The incorporate...


J Med Chem 41: 4890-902 (1998)


Article DOI: 10.1021/jm980462b
BindingDB Entry DOI: 10.7270/Q2ZS2TRS
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM14476
PNG
(3-bromo-8-chloro-7-fluoro-11-{4-[(1-oxidopyridin-4...)
Show SMILES [O-][n+]1ccc(CC(=O)N2CCN(CC2)C2c3ccc(Cl)c(F)c3CCc3cc(Br)cnc23)cc1
Show InChI InChI=1S/C25H23BrClFN4O2/c26-18-14-17-1-2-19-20(3-4-21(27)23(19)28)25(24(17)29-15-18)31-11-9-30(10-12-31)22(33)13-16-5-7-32(34)8-6-16/h3-8,14-15,25H,1-2,9-13H2
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n/an/a 86n/an/an/an/a7.522



Schering-Plough Research Institute



Assay Description
FPT activity was determined by measuring transfer of [3H] farnesyl from [3H]farnesyl pyrophosphate to the substrate His6-Ha-Ras-CVLS. The incorporate...


J Med Chem 41: 4890-902 (1998)


Article DOI: 10.1021/jm980462b
BindingDB Entry DOI: 10.7270/Q2ZS2TRS
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM14458
PNG
((-)-4-(8-Chloro-3,10-dibromo-6,11-dihydro-5H-benzo...)
Show SMILES [O-][n+]1ccc(CC(=O)N2CCC(CC2)[C@@H]2c3ncc(Br)cc3CCc3cc(Cl)cc(Br)c23)cc1 |r|
Show InChI InChI=1S/C26H24Br2ClN3O2/c27-20-12-19-2-1-18-13-21(29)14-22(28)24(18)25(26(19)30-15-20)17-5-7-31(8-6-17)23(33)11-16-3-9-32(34)10-4-16/h3-4,9-10,12-15,17,25H,1-2,5-8,11H2/t25-/m0/s1
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Article
PubMed
n/an/a>88n/an/an/an/a7.522



Schering-Plough Research Institute



Assay Description
FPT activity was determined by measuring transfer of [3H] farnesyl from [3H]farnesyl pyrophosphate to the substrate His6-Ha-Ras-CVLS. The incorporate...


J Med Chem 41: 4890-902 (1998)


Article DOI: 10.1021/jm980462b
BindingDB Entry DOI: 10.7270/Q2ZS2TRS
More data for this
Ligand-Target Pair
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