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PubMed code 10450988

Compile data set for download or QSAR
Found 51 hits of Enzyme Inhibition Constant Data   
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
Geranylgeranyl Transferase (GGTase-I)


(Bos taurus (bovine))
BDBM50059858
PNG
((S)-2-((3Z,6E)-(2S,5S,8R)-8-Amino-2-benzyl-5-isopr...)
Show SMILES CSCC[C@H](NC(=O)[C@@H](Cc1ccccc1)\C=C/[C@@H](\C=C\[C@@H](N)CS)C(C)C)C(O)=O
Show InChI InChI=1S/C24H36N2O3S2/c1-17(2)19(11-12-21(25)16-30)9-10-20(15-18-7-5-4-6-8-18)23(27)26-22(24(28)29)13-14-31-3/h4-12,17,19-22,30H,13-16,25H2,1-3H3,(H,26,27)(H,28,29)/b10-9-,12-11+/t19-,20+,21+,22-/m0/s1
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n/an/a 1n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Geranylgeranyl transferase in the geranylgeranylation of H-ras-CAIL protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Bos taurus (bovine))
BDBM50079813
PNG
(2-[1-[5-amino-6-sulfanyl-(5R)-hexanoyl]-4-phenoxy-...)
Show SMILES CSCC[C@H](NC(=O)[C@@H]1C[C@@H](CN1C(=O)CCC[C@@H](N)CS)Oc1ccccc1)C(O)=O
Show InChI InChI=1S/C22H33N3O5S2/c1-32-11-10-18(22(28)29)24-21(27)19-12-17(30-16-7-3-2-4-8-16)13-25(19)20(26)9-5-6-15(23)14-31/h2-4,7-8,15,17-19,31H,5-6,9-14,23H2,1H3,(H,24,27)(H,28,29)/t15-,17+,18+,19+/m1/s1
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n/an/a 2n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration was evaluated against Farnesyltransferase in the farnesylation of H-ras protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Geranylgeranyl Transferase (GGTase-I)


(Bos taurus (bovine))
BDBM50079803
PNG
((S)-2-{[(2S,4S)-1-((E)-(2S,5R)-5-Amino-2-isopropyl...)
Show SMILES CSCC[C@H](NC(=O)[C@@H]1C[C@@H](CN1C(=O)[C@H](\C=C\[C@@H](N)CS)C(C)C)Oc1ccccc1)C(O)=O
Show InChI InChI=1S/C25H37N3O5S2/c1-16(2)20(10-9-17(26)15-34)24(30)28-14-19(33-18-7-5-4-6-8-18)13-22(28)23(29)27-21(25(31)32)11-12-35-3/h4-10,16-17,19-22,34H,11-15,26H2,1-3H3,(H,27,29)(H,31,32)/b10-9+/t17-,19+,20-,21+,22+/m1/s1
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n/an/a 11n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Geranylgeranyl transferase in the geranylgeranylation of H-ras-CAIL protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Bos taurus (bovine))
BDBM50079810
PNG
(2-[1-[5-amino-2-isopropyl-6-sulfanyl-(2S,3E,5R)-3-...)
Show SMILES CSCC[C@H](NC(=O)[C@@H]1C[C@@H](CN1C[C@H](\C=C\[C@@H](N)CS)C(C)C)Oc1ccccc1)C(O)=O
Show InChI InChI=1S/C25H39N3O4S2/c1-17(2)18(9-10-19(26)16-33)14-28-15-21(32-20-7-5-4-6-8-20)13-23(28)24(29)27-22(25(30)31)11-12-34-3/h4-10,17-19,21-23,33H,11-16,26H2,1-3H3,(H,27,29)(H,30,31)/b10-9+/t18-,19+,21-,22-,23-/m0/s1
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n/an/a 17n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration was evaluated against Farnesyltransferase in the farnesylation of H-ras protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Bos taurus (bovine))
BDBM50079803
PNG
((S)-2-{[(2S,4S)-1-((E)-(2S,5R)-5-Amino-2-isopropyl...)
Show SMILES CSCC[C@H](NC(=O)[C@@H]1C[C@@H](CN1C(=O)[C@H](\C=C\[C@@H](N)CS)C(C)C)Oc1ccccc1)C(O)=O
Show InChI InChI=1S/C25H37N3O5S2/c1-16(2)20(10-9-17(26)15-34)24(30)28-14-19(33-18-7-5-4-6-8-18)13-22(28)23(29)27-21(25(31)32)11-12-35-3/h4-10,16-17,19-22,34H,11-15,26H2,1-3H3,(H,27,29)(H,31,32)/b10-9+/t17-,19+,20-,21+,22+/m1/s1
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n/an/a 18n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration was evaluated against Farnesyltransferase in the farnesylation of H-ras protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Bos taurus (bovine))
BDBM50079786
PNG
(2-[1-[5-amino-6-sulfanyl-(5R)-hexyl]-4-phenoxy-(2S...)
Show SMILES CSCC[C@H](NC(=O)[C@@H]1C[C@@H](CN1CCCC[C@@H](N)CS)Oc1ccccc1)C(O)=O
Show InChI InChI=1S/C22H35N3O4S2/c1-31-12-10-19(22(27)28)24-21(26)20-13-18(29-17-8-3-2-4-9-17)14-25(20)11-6-5-7-16(23)15-30/h2-4,8-9,16,18-20,30H,5-7,10-15,23H2,1H3,(H,24,26)(H,27,28)/t16-,18+,19+,20+/m1/s1
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n/an/a 20n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration was evaluated against Farnesyltransferase in the farnesylation of H-ras protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Bos taurus (bovine))
BDBM50079793
PNG
(2-[1-[5-amino-6-sulfanyl-(E,5R)-3-hexenyl]-4-pheno...)
Show SMILES CSCC[C@H](NC(=O)[C@@H]1C[C@@H](CN1CC\C=C\[C@@H](N)CS)Oc1ccccc1)C(O)=O
Show InChI InChI=1S/C22H33N3O4S2/c1-31-12-10-19(22(27)28)24-21(26)20-13-18(29-17-8-3-2-4-9-17)14-25(20)11-6-5-7-16(23)15-30/h2-5,7-9,16,18-20,30H,6,10-15,23H2,1H3,(H,24,26)(H,27,28)/b7-5+/t16-,18+,19+,20+/m1/s1
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n/an/a 20n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration was evaluated against Farnesyltransferase in the farnesylation of H-ras protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Bos taurus (bovine))
BDBM50059858
PNG
((S)-2-((3Z,6E)-(2S,5S,8R)-8-Amino-2-benzyl-5-isopr...)
Show SMILES CSCC[C@H](NC(=O)[C@@H](Cc1ccccc1)\C=C/[C@@H](\C=C\[C@@H](N)CS)C(C)C)C(O)=O
Show InChI InChI=1S/C24H36N2O3S2/c1-17(2)19(11-12-21(25)16-30)9-10-20(15-18-7-5-4-6-8-18)23(27)26-22(24(28)29)13-14-31-3/h4-12,17,19-22,30H,13-16,25H2,1-3H3,(H,26,27)(H,28,29)/b10-9-,12-11+/t19-,20+,21+,22-/m0/s1
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n/an/a 26n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration was evaluated against Farnesyltransferase in the farnesylation of H-ras protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Bos taurus (bovine))
BDBM50079804
PNG
(2-[1-[4-amino-5-sulfanyl-(E,4R)-2-pentenyl]-4-(4-p...)
Show SMILES CSCC[C@H](NC(=O)[C@@H]1C[C@@H](CN1C\C=C\[C@@H](N)CS)Oc1ccc(cc1)-c1ccccc1)C(O)=O
Show InChI InChI=1S/C27H35N3O4S2/c1-36-15-13-24(27(32)33)29-26(31)25-16-23(17-30(25)14-5-8-21(28)18-35)34-22-11-9-20(10-12-22)19-6-3-2-4-7-19/h2-12,21,23-25,35H,13-18,28H2,1H3,(H,29,31)(H,32,33)/b8-5+/t21-,23+,24+,25+/m1/s1
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n/an/a 35n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration was evaluated against Farnesyltransferase in the farnesylation of H-ras protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein farnesyltransferase beta/geranylgeranyltransferase type I alpha subunit


(Mus musculus)
BDBM50079787
PNG
(CHEMBL303859 | methyl 2-[1-[5-amino-2-isopropyl-6-...)
Show SMILES COC(=O)[C@H](CCSC)NC(=O)[C@@H]1C[C@@H](CN1C[C@H](\C=C\[C@@H](N)CS)C(C)C)Oc1ccccc1
Show InChI InChI=1S/C26H41N3O4S2/c1-18(2)19(10-11-20(27)17-34)15-29-16-22(33-21-8-6-5-7-9-21)14-24(29)25(30)28-23(12-13-35-4)26(31)32-3/h5-11,18-20,22-24,34H,12-17,27H2,1-4H3,(H,28,30)/b11-10+/t19-,20+,22-,23-,24-/m0/s1
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n/an/a 40n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration against Farnesyltransferase for Farnesylation of H-ras protein InNIH 3T3 cells transformed with activated H-ras


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Bos taurus (bovine))
BDBM50079809
PNG
((S)-2-{[(2S,4S)-1-((E)-(R)-4-Amino-5-mercapto-pent...)
Show SMILES CSCC[C@H](NC(=O)[C@@H]1C[C@@H](CN1C\C=C\[C@@H](N)CS)Oc1cccc2CCCCc12)C(O)=O
Show InChI InChI=1S/C25H37N3O4S2/c1-34-13-11-21(25(30)31)27-24(29)22-14-19(15-28(22)12-5-8-18(26)16-33)32-23-10-4-7-17-6-2-3-9-20(17)23/h4-5,7-8,10,18-19,21-22,33H,2-3,6,9,11-16,26H2,1H3,(H,27,29)(H,30,31)/b8-5+/t18-,19+,21+,22+/m1/s1
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n/an/a 47n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration was evaluated against Farnesyltransferase in the farnesylation of H-ras protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Geranylgeranyl Transferase (GGTase-I)


(Bos taurus (bovine))
BDBM50403711
PNG
(CHEMBL2092855)
Show SMILES CSCC[C@@H](NC(=O)[C@@H]1C[C@@H](CN1C\C=C\[C@@H](N)CS)Oc1ccccc1)C(O)=O
Show InChI InChI=1S/C21H31N3O4S2/c1-30-11-9-18(21(26)27)23-20(25)19-12-17(28-16-7-3-2-4-8-16)13-24(19)10-5-6-15(22)14-29/h2-8,15,17-19,29H,9-14,22H2,1H3,(H,23,25)(H,26,27)/b6-5+/t15-,17+,18-,19+/m1/s1
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n/an/a 53n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Geranylgeranyl transferase in the geranylgeranylation of H-ras-CAIL protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Bos taurus (bovine))
BDBM50403711
PNG
(CHEMBL2092855)
Show SMILES CSCC[C@@H](NC(=O)[C@@H]1C[C@@H](CN1C\C=C\[C@@H](N)CS)Oc1ccccc1)C(O)=O
Show InChI InChI=1S/C21H31N3O4S2/c1-30-11-9-18(21(26)27)23-20(25)19-12-17(28-16-7-3-2-4-8-16)13-24(19)10-5-6-15(22)14-29/h2-8,15,17-19,29H,9-14,22H2,1H3,(H,23,25)(H,26,27)/b6-5+/t15-,17+,18-,19+/m1/s1
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n/an/a 57n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Geranylgeranyl transferase in the geranylgeranylation of H-ras-CAIL protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Bos taurus (bovine))
BDBM50079811
PNG
(2-[1-[4-amino-5-sulfanyl-(E,4R)-2-pentenyl]-4-(4-i...)
Show SMILES CSCC[C@H](NC(=O)[C@@H]1C[C@@H](CN1C\C=C\[C@@H](N)CS)Oc1ccc(cc1)C(C)C)C(O)=O
Show InChI InChI=1S/C24H37N3O4S2/c1-16(2)17-6-8-19(9-7-17)31-20-13-22(27(14-20)11-4-5-18(25)15-32)23(28)26-21(24(29)30)10-12-33-3/h4-9,16,18,20-22,32H,10-15,25H2,1-3H3,(H,26,28)(H,29,30)/b5-4+/t18-,20+,21+,22+/m1/s1
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n/an/a 82n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration was evaluated against Farnesyltransferase in the farnesylation of H-ras protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Bos taurus (bovine))
BDBM50079792
PNG
(2-[1-[4-amino-5-sulfanyl-(E,4R)-2-pentenyl]-4-(4-b...)
Show SMILES CCCCc1ccc(O[C@H]2C[C@H](N(C\C=C\[C@@H](N)CS)C2)C(=O)N[C@@H](CCSC)C(O)=O)cc1
Show InChI InChI=1S/C25H39N3O4S2/c1-3-4-6-18-8-10-20(11-9-18)32-21-15-23(28(16-21)13-5-7-19(26)17-33)24(29)27-22(25(30)31)12-14-34-2/h5,7-11,19,21-23,33H,3-4,6,12-17,26H2,1-2H3,(H,27,29)(H,30,31)/b7-5+/t19-,21+,22+,23+/m1/s1
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n/an/a 87n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration was evaluated against Farnesyltransferase in the farnesylation of H-ras protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Geranylgeranyl Transferase (GGTase-I)


(Bos taurus (bovine))
BDBM50079809
PNG
((S)-2-{[(2S,4S)-1-((E)-(R)-4-Amino-5-mercapto-pent...)
Show SMILES CSCC[C@H](NC(=O)[C@@H]1C[C@@H](CN1C\C=C\[C@@H](N)CS)Oc1cccc2CCCCc12)C(O)=O
Show InChI InChI=1S/C25H37N3O4S2/c1-34-13-11-21(25(30)31)27-24(29)22-14-19(15-28(22)12-5-8-18(26)16-33)32-23-10-4-7-17-6-2-3-9-20(17)23/h4-5,7-8,10,18-19,21-22,33H,2-3,6,9,11-16,26H2,1H3,(H,27,29)(H,30,31)/b8-5+/t18-,19+,21+,22+/m1/s1
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n/an/a 89n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Geranylgeranyl transferase in the geranylgeranylation of H-ras-CAIL protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Bos taurus (bovine))
BDBM50216999
PNG
(CHEMBL3349357)
Show SMILES OC(=O)C(F)(F)F.OC(=O)C(F)(F)F.CSCC[C@H](NC(=O)[C@@H]1C[C@@H](CN1C\C=C\C(N)CS)Oc1cccc2ccccc12)C(O)=O
Show InChI InChI=1S/C25H33N3O4S2.2C2HF3O2/c1-34-13-11-21(25(30)31)27-24(29)22-14-19(15-28(22)12-5-8-18(26)16-33)32-23-10-4-7-17-6-2-3-9-20(17)23;2*3-2(4,5)1(6)7/h2-10,18-19,21-22,33H,11-16,26H2,1H3,(H,27,29)(H,30,31);2*(H,6,7)/b8-5+;;/t18?,19-,21-,22-;;/m0../s1
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n/an/a 100n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration was evaluated against Farnesyltransferase in the farnesylation of H-ras protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Geranylgeranyl Transferase (GGTase-I)


(Bos taurus (bovine))
BDBM50079813
PNG
(2-[1-[5-amino-6-sulfanyl-(5R)-hexanoyl]-4-phenoxy-...)
Show SMILES CSCC[C@H](NC(=O)[C@@H]1C[C@@H](CN1C(=O)CCC[C@@H](N)CS)Oc1ccccc1)C(O)=O
Show InChI InChI=1S/C22H33N3O5S2/c1-32-11-10-18(22(28)29)24-21(27)19-12-17(30-16-7-3-2-4-8-16)13-25(19)20(26)9-5-6-15(23)14-31/h2-4,7-8,15,17-19,31H,5-6,9-14,23H2,1H3,(H,24,27)(H,28,29)/t15-,17+,18+,19+/m1/s1
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n/an/a 100n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Geranylgeranyl transferase in the geranylgeranylation of H-ras-CAIL protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Bos taurus (bovine))
BDBM50079794
PNG
(2-[1-[4-amino-5-sulfanyl-(E,4R)-2-pentenyl]-4-(4-t...)
Show SMILES CSCC[C@H](NC(=O)[C@@H]1C[C@@H](CN1C\C=C\[C@@H](N)CS)Oc1ccc(cc1)C(F)(F)F)C(O)=O
Show InChI InChI=1S/C22H30F3N3O4S2/c1-34-10-8-18(21(30)31)27-20(29)19-11-17(12-28(19)9-2-3-15(26)13-33)32-16-6-4-14(5-7-16)22(23,24)25/h2-7,15,17-19,33H,8-13,26H2,1H3,(H,27,29)(H,30,31)/b3-2+/t15-,17+,18+,19+/m1/s1
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n/an/a 110n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration was evaluated against Farnesyltransferase in the farnesylation of H-ras protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Geranylgeranyl Transferase (GGTase-I)


(Bos taurus (bovine))
BDBM50079794
PNG
(2-[1-[4-amino-5-sulfanyl-(E,4R)-2-pentenyl]-4-(4-t...)
Show SMILES CSCC[C@H](NC(=O)[C@@H]1C[C@@H](CN1C\C=C\[C@@H](N)CS)Oc1ccc(cc1)C(F)(F)F)C(O)=O
Show InChI InChI=1S/C22H30F3N3O4S2/c1-34-10-8-18(21(30)31)27-20(29)19-11-17(12-28(19)9-2-3-15(26)13-33)32-16-6-4-14(5-7-16)22(23,24)25/h2-7,15,17-19,33H,8-13,26H2,1H3,(H,27,29)(H,30,31)/b3-2+/t15-,17+,18+,19+/m1/s1
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n/an/a 110n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Geranylgeranyl transferase in the geranylgeranylation of H-ras-CAIL protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Geranylgeranyl Transferase (GGTase-I)


(Bos taurus (bovine))
BDBM50079810
PNG
(2-[1-[5-amino-2-isopropyl-6-sulfanyl-(2S,3E,5R)-3-...)
Show SMILES CSCC[C@H](NC(=O)[C@@H]1C[C@@H](CN1C[C@H](\C=C\[C@@H](N)CS)C(C)C)Oc1ccccc1)C(O)=O
Show InChI InChI=1S/C25H39N3O4S2/c1-17(2)18(9-10-19(26)16-33)14-28-15-21(32-20-7-5-4-6-8-20)13-23(28)24(29)27-22(25(30)31)11-12-34-3/h4-10,17-19,21-23,33H,11-16,26H2,1-3H3,(H,27,29)(H,30,31)/b10-9+/t18-,19+,21-,22-,23-/m0/s1
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Eisai Research Institute

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Geranylgeranyl transferase in the geranylgeranylation of H-ras-CAIL protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Geranylgeranyl Transferase (GGTase-I)


(Bos taurus (bovine))
BDBM50079806
PNG
(2-[1-[4-amino-5-sulfanyl-(E,4R)-2-pentenyl]-4-(2-p...)
Show SMILES CCCc1ccccc1O[C@H]1C[C@H](N(C\C=C\[C@@H](N)CS)C1)C(=O)N[C@@H](CCSC)C(O)=O
Show InChI InChI=1S/C24H37N3O4S2/c1-3-7-17-8-4-5-10-22(17)31-19-14-21(27(15-19)12-6-9-18(25)16-32)23(28)26-20(24(29)30)11-13-33-2/h4-6,8-10,18-21,32H,3,7,11-16,25H2,1-2H3,(H,26,28)(H,29,30)/b9-6+/t18-,19+,20+,21+/m1/s1
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Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration against Farnesyltransferase for Farnesylation of H-ras protein InNIH 3T3 cells transformed with activated H-ras


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Geranylgeranyl Transferase (GGTase-I)


(Bos taurus (bovine))
BDBM50079792
PNG
(2-[1-[4-amino-5-sulfanyl-(E,4R)-2-pentenyl]-4-(4-b...)
Show SMILES CCCCc1ccc(O[C@H]2C[C@H](N(C\C=C\[C@@H](N)CS)C2)C(=O)N[C@@H](CCSC)C(O)=O)cc1
Show InChI InChI=1S/C25H39N3O4S2/c1-3-4-6-18-8-10-20(11-9-18)32-21-15-23(28(16-21)13-5-7-19(26)17-33)24(29)27-22(25(30)31)12-14-34-2/h5,7-11,19,21-23,33H,3-4,6,12-17,26H2,1-2H3,(H,27,29)(H,30,31)/b7-5+/t19-,21+,22+,23+/m1/s1
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Eisai Research Institute

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Geranylgeranyl transferase in the geranylgeranylation of H-ras-CAIL protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Geranylgeranyl Transferase (GGTase-I)


(Bos taurus (bovine))
BDBM50216999
PNG
(CHEMBL3349357)
Show SMILES OC(=O)C(F)(F)F.OC(=O)C(F)(F)F.CSCC[C@H](NC(=O)[C@@H]1C[C@@H](CN1C\C=C\C(N)CS)Oc1cccc2ccccc12)C(O)=O
Show InChI InChI=1S/C25H33N3O4S2.2C2HF3O2/c1-34-13-11-21(25(30)31)27-24(29)22-14-19(15-28(22)12-5-8-18(26)16-33)32-23-10-4-7-17-6-2-3-9-20(17)23;2*3-2(4,5)1(6)7/h2-10,18-19,21-22,33H,11-16,26H2,1H3,(H,27,29)(H,30,31);2*(H,6,7)/b8-5+;;/t18?,19-,21-,22-;;/m0../s1
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n/an/a 200n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration was evaluated against Farnesyltransferase in the farnesylation of H-ras protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Bos taurus (bovine))
BDBM50079806
PNG
(2-[1-[4-amino-5-sulfanyl-(E,4R)-2-pentenyl]-4-(2-p...)
Show SMILES CCCc1ccccc1O[C@H]1C[C@H](N(C\C=C\[C@@H](N)CS)C1)C(=O)N[C@@H](CCSC)C(O)=O
Show InChI InChI=1S/C24H37N3O4S2/c1-3-7-17-8-4-5-10-22(17)31-19-14-21(27(15-19)12-6-9-18(25)16-32)23(28)26-20(24(29)30)11-13-33-2/h4-6,8-10,18-21,32H,3,7,11-16,25H2,1-2H3,(H,26,28)(H,29,30)/b9-6+/t18-,19+,20+,21+/m1/s1
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Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration was evaluated against Farnesyltransferase in the farnesylation of H-ras protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Geranylgeranyl Transferase (GGTase-I)


(Bos taurus (bovine))
BDBM50079811
PNG
(2-[1-[4-amino-5-sulfanyl-(E,4R)-2-pentenyl]-4-(4-i...)
Show SMILES CSCC[C@H](NC(=O)[C@@H]1C[C@@H](CN1C\C=C\[C@@H](N)CS)Oc1ccc(cc1)C(C)C)C(O)=O
Show InChI InChI=1S/C24H37N3O4S2/c1-16(2)17-6-8-19(9-7-17)31-20-13-22(27(14-20)11-4-5-18(25)15-32)23(28)26-21(24(29)30)10-12-33-3/h4-9,16,18,20-22,32H,10-15,25H2,1-3H3,(H,26,28)(H,29,30)/b5-4+/t18-,20+,21+,22+/m1/s1
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Eisai Research Institute

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Geranylgeranyl transferase in the geranylgeranylation of H-ras-CAIL protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Geranylgeranyl Transferase (GGTase-I)


(Bos taurus (bovine))
BDBM50079804
PNG
(2-[1-[4-amino-5-sulfanyl-(E,4R)-2-pentenyl]-4-(4-p...)
Show SMILES CSCC[C@H](NC(=O)[C@@H]1C[C@@H](CN1C\C=C\[C@@H](N)CS)Oc1ccc(cc1)-c1ccccc1)C(O)=O
Show InChI InChI=1S/C27H35N3O4S2/c1-36-15-13-24(27(32)33)29-26(31)25-16-23(17-30(25)14-5-8-21(28)18-35)34-22-11-9-20(10-12-22)19-6-3-2-4-7-19/h2-12,21,23-25,35H,13-18,28H2,1H3,(H,29,31)(H,32,33)/b8-5+/t21-,23+,24+,25+/m1/s1
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Eisai Research Institute

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Geranylgeranyl transferase in the geranylgeranylation of H-ras-CAIL protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein farnesyltransferase beta/geranylgeranyltransferase type I alpha subunit


(Mus musculus)
BDBM50079805
PNG
(CHEMBL302834 | methyl 2-[1-[5-amino-6-sulfanyl-(5R...)
Show SMILES COC(=O)[C@H](CCSC)NC(=O)[C@@H]1C[C@@H](CN1CCCC[C@@H](N)CS)Oc1ccccc1
Show InChI InChI=1S/C23H37N3O4S2/c1-29-23(28)20(11-13-32-2)25-22(27)21-14-19(30-18-9-4-3-5-10-18)15-26(21)12-7-6-8-17(24)16-31/h3-5,9-10,17,19-21,31H,6-8,11-16,24H2,1-2H3,(H,25,27)/t17-,19+,20+,21+/m1/s1
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n/an/a 350n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration against Farnesyltransferase for Farnesylation of H-ras protein InNIH 3T3 cells transformed with activated H-ras


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein farnesyltransferase beta/geranylgeranyltransferase type I alpha subunit


(Mus musculus)
BDBM50059858
PNG
((S)-2-((3Z,6E)-(2S,5S,8R)-8-Amino-2-benzyl-5-isopr...)
Show SMILES CSCC[C@H](NC(=O)[C@@H](Cc1ccccc1)\C=C/[C@@H](\C=C\[C@@H](N)CS)C(C)C)C(O)=O
Show InChI InChI=1S/C24H36N2O3S2/c1-17(2)19(11-12-21(25)16-30)9-10-20(15-18-7-5-4-6-8-18)23(27)26-22(24(28)29)13-14-31-3/h4-12,17,19-22,30H,13-16,25H2,1-3H3,(H,26,27)(H,28,29)/b10-9-,12-11+/t19-,20+,21+,22-/m0/s1
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n/an/a 370n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration against Farnesyltransferase for Farnesylation of H-ras protein InNIH 3T3 cells transformed with activated H-ras


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Bos taurus (bovine))
BDBM50366603
PNG
(CHEMBL1793799 | CHEMBL3349310)
Show SMILES OC(=O)C(F)(F)F.OC(=O)C(F)(F)F.COc1ccc(O[C@H]2C[C@@H](N(C\C=C\[C@@H](N)CS)C2)C(=O)N[C@H](CCSC)C(O)=O)cc1OC
Show InChI InChI=1S/C23H35N3O6S2/c1-30-20-7-6-16(12-21(20)31-2)32-17-11-19(26(13-17)9-4-5-15(24)14-33)22(27)25-18(23(28)29)8-10-34-3/h4-7,12,15,17-19,33H,8-11,13-14,24H2,1-3H3,(H,25,27)(H,28,29)/t15-,17+,18-,19-/m1/s1
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Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration was evaluated against Farnesyltransferase in the farnesylation of H-ras protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein farnesyltransferase beta/geranylgeranyltransferase type I alpha subunit


(Mus musculus)
BDBM50079785
PNG
(CHEMBL433102 | methyl 2-[1-[5-amino-6-sulfanyl-(E,...)
Show SMILES COC(=O)[C@H](CCSC)NC(=O)[C@@H]1C[C@@H](CN1CC\C=C\[C@@H](N)CS)Oc1ccccc1
Show InChI InChI=1S/C23H35N3O4S2/c1-29-23(28)20(11-13-32-2)25-22(27)21-14-19(30-18-9-4-3-5-10-18)15-26(21)12-7-6-8-17(24)16-31/h3-6,8-10,17,19-21,31H,7,11-16,24H2,1-2H3,(H,25,27)/b8-6+/t17-,19+,20+,21+/m1/s1
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n/an/a 490n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration against Farnesyltransferase for Farnesylation of H-ras protein InNIH 3T3 cells transformed with activated H-ras


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Geranylgeranyl Transferase (GGTase-I)


(Bos taurus (bovine))
BDBM50079793
PNG
(2-[1-[5-amino-6-sulfanyl-(E,5R)-3-hexenyl]-4-pheno...)
Show SMILES CSCC[C@H](NC(=O)[C@@H]1C[C@@H](CN1CC\C=C\[C@@H](N)CS)Oc1ccccc1)C(O)=O
Show InChI InChI=1S/C22H33N3O4S2/c1-31-12-10-19(22(27)28)24-21(26)20-13-18(29-17-8-3-2-4-9-17)14-25(20)11-6-5-7-16(23)15-30/h2-5,7-9,16,18-20,30H,6,10-15,23H2,1H3,(H,24,26)(H,27,28)/b7-5+/t16-,18+,19+,20+/m1/s1
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Eisai Research Institute

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Geranylgeranyl transferase in the geranylgeranylation of H-ras-CAIL protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein farnesyltransferase beta/geranylgeranyltransferase type I alpha subunit


(Mus musculus)
BDBM50079790
PNG
((S)-2-{[(2S,4S)-1-((E)-(2S,5R)-5-Amino-2-isopropyl...)
Show SMILES COC(=O)[C@H](CCSC)NC(=O)[C@@H]1C[C@@H](CN1C(=O)[C@H](\C=C\[C@@H](N)CS)C(C)C)Oc1ccccc1
Show InChI InChI=1S/C26H39N3O5S2/c1-17(2)21(11-10-18(27)16-35)25(31)29-15-20(34-19-8-6-5-7-9-19)14-23(29)24(30)28-22(12-13-36-4)26(32)33-3/h5-11,17-18,20-23,35H,12-16,27H2,1-4H3,(H,28,30)/b11-10+/t18-,20+,21-,22+,23+/m1/s1
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n/an/a 840n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration against Farnesyltransferase for Farnesylation of H-ras protein InNIH 3T3 cells transformed with activated H-ras


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein farnesyltransferase beta/geranylgeranyltransferase type I alpha subunit


(Mus musculus)
BDBM50079800
PNG
(CHEMBL303363 | methyl 2-[1-[5-amino-6-sulfanyl-(5R...)
Show SMILES COC(=O)[C@H](CCSC)NC(=O)[C@@H]1C[C@@H](CN1C(=O)CCC[C@@H](N)CS)Oc1ccccc1
Show InChI InChI=1S/C23H35N3O5S2/c1-30-23(29)19(11-12-33-2)25-22(28)20-13-18(31-17-8-4-3-5-9-17)14-26(20)21(27)10-6-7-16(24)15-32/h3-5,8-9,16,18-20,32H,6-7,10-15,24H2,1-2H3,(H,25,28)/t16-,18+,19+,20+/m1/s1
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n/an/a 2.00E+3n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration against Farnesyltransferase for Farnesylation of H-ras protein InNIH 3T3 cells transformed with activated H-ras


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein farnesyltransferase beta/geranylgeranyltransferase type I alpha subunit


(Mus musculus)
BDBM50079802
PNG
(CHEMBL302025 | methyl 2-[1-[4-amino-5-sulfanyl-(E,...)
Show SMILES COC(=O)[C@H](CCSC)NC(=O)[C@@H]1C[C@@H](CN1C\C=C\[C@@H](N)CS)Oc1ccc(cc1)C(C)C
Show InChI InChI=1S/C25H39N3O4S2/c1-17(2)18-7-9-20(10-8-18)32-21-14-23(28(15-21)12-5-6-19(26)16-33)24(29)27-22(11-13-34-4)25(30)31-3/h5-10,17,19,21-23,33H,11-16,26H2,1-4H3,(H,27,29)/b6-5+/t19-,21+,22+,23+/m1/s1
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n/an/a 3.00E+3n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration against Farnesyltransferase for Farnesylation of H-ras protein InNIH 3T3 cells transformed with activated H-ras


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein farnesyltransferase beta/geranylgeranyltransferase type I alpha subunit


(Mus musculus)
BDBM50079791
PNG
(CHEMBL304823 | methyl 2-[1-[4-amino-5-sulfanyl-(E,...)
Show SMILES CCCCc1ccc(O[C@H]2C[C@H](N(C\C=C\[C@@H](N)CS)C2)C(=O)N[C@@H](CCSC)C(=O)OC)cc1
Show InChI InChI=1S/C26H41N3O4S2/c1-4-5-7-19-9-11-21(12-10-19)33-22-16-24(29(17-22)14-6-8-20(27)18-34)25(30)28-23(13-15-35-3)26(31)32-2/h6,8-12,20,22-24,34H,4-5,7,13-18,27H2,1-3H3,(H,28,30)/b8-6+/t20-,22+,23+,24+/m1/s1
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n/an/a 3.20E+3n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration against Farnesyltransferase for Farnesylation of H-ras protein InNIH 3T3 cells transformed with activated H-ras


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Bos taurus (bovine))
BDBM50403713
PNG
(CHEMBL2092731)
Show SMILES CSCC[C@@H](NC(=O)[C@H]1C[C@@H](CN1C\C=C\[C@@H](N)CS)Oc1ccccc1)C(O)=O
Show InChI InChI=1S/C21H31N3O4S2/c1-30-11-9-18(21(26)27)23-20(25)19-12-17(28-16-7-3-2-4-8-16)13-24(19)10-5-6-15(22)14-29/h2-8,15,17-19,29H,9-14,22H2,1H3,(H,23,25)(H,26,27)/b6-5+/t15-,17+,18-,19-/m1/s1
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n/an/a 3.30E+3n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration was evaluated against Farnesyltransferase in the farnesylation of H-ras protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Geranylgeranyl Transferase (GGTase-I)


(Bos taurus (bovine))
BDBM50079786
PNG
(2-[1-[5-amino-6-sulfanyl-(5R)-hexyl]-4-phenoxy-(2S...)
Show SMILES CSCC[C@H](NC(=O)[C@@H]1C[C@@H](CN1CCCC[C@@H](N)CS)Oc1ccccc1)C(O)=O
Show InChI InChI=1S/C22H35N3O4S2/c1-31-12-10-19(22(27)28)24-21(26)20-13-18(29-17-8-3-2-4-9-17)14-25(20)11-6-5-7-16(23)15-30/h2-4,8-9,16,18-20,30H,5-7,10-15,23H2,1H3,(H,24,26)(H,27,28)/t16-,18+,19+,20+/m1/s1
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n/an/a 3.30E+3n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Geranylgeranyl transferase in the geranylgeranylation of H-ras-CAIL protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein farnesyltransferase beta/geranylgeranyltransferase type I alpha subunit


(Mus musculus)
BDBM50079797
PNG
(CHEMBL66788 | methyl 2-[1-[4-amino-5-sulfanyl-(E,4...)
Show SMILES COC(=O)[C@H](CCSC)NC(=O)[C@@H]1C[C@@H](CN1C\C=C\[C@@H](N)CS)Oc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C28H37N3O4S2/c1-34-28(33)25(14-16-37-2)30-27(32)26-17-24(18-31(26)15-6-9-22(29)19-36)35-23-12-10-21(11-13-23)20-7-4-3-5-8-20/h3-13,22,24-26,36H,14-19,29H2,1-2H3,(H,30,32)/b9-6+/t22-,24+,25+,26+/m1/s1
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n/an/a 3.30E+3n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration against Farnesyltransferase for Farnesylation of H-ras protein InNIH 3T3 cells transformed with activated H-ras


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Bos taurus (bovine))
BDBM50079812
PNG
((S)-2-{[(2S,4R)-1-((E)-(R)-4-Amino-5-mercapto-pent...)
Show SMILES CSCC[C@H](NC(=O)[C@@H]1C[C@H](CN1C\C=C\[C@@H](N)CS)Oc1ccccc1)C(O)=O
Show InChI InChI=1S/C21H31N3O4S2/c1-30-11-9-18(21(26)27)23-20(25)19-12-17(28-16-7-3-2-4-8-16)13-24(19)10-5-6-15(22)14-29/h2-8,15,17-19,29H,9-14,22H2,1H3,(H,23,25)(H,26,27)/b6-5+/t15-,17-,18+,19+/m1/s1
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n/an/a 4.00E+3n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration was evaluated against Farnesyltransferase in the farnesylation of H-ras protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein farnesyltransferase beta/geranylgeranyltransferase type I alpha subunit


(Mus musculus)
BDBM50403712
PNG
(CHEMBL2092732)
Show SMILES COC(=O)[C@@H](CCSC)NC(=O)[C@@H]1C[C@@H](CN1C\C=C\[C@@H](N)CS)Oc1ccccc1
Show InChI InChI=1S/C22H33N3O4S2/c1-28-22(27)19(10-12-31-2)24-21(26)20-13-18(29-17-8-4-3-5-9-17)14-25(20)11-6-7-16(23)15-30/h3-9,16,18-20,30H,10-15,23H2,1-2H3,(H,24,26)/b7-6+/t16-,18+,19-,20+/m1/s1
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n/an/a 5.30E+3n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration against Farnesyltransferase for Farnesylation of H-ras protein InNIH 3T3 cells transformed with activated H-ras


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Geranylgeranyl Transferase (GGTase-I)


(Bos taurus (bovine))
BDBM50079812
PNG
((S)-2-{[(2S,4R)-1-((E)-(R)-4-Amino-5-mercapto-pent...)
Show SMILES CSCC[C@H](NC(=O)[C@@H]1C[C@H](CN1C\C=C\[C@@H](N)CS)Oc1ccccc1)C(O)=O
Show InChI InChI=1S/C21H31N3O4S2/c1-30-11-9-18(21(26)27)23-20(25)19-12-17(28-16-7-3-2-4-8-16)13-24(19)10-5-6-15(22)14-29/h2-8,15,17-19,29H,9-14,22H2,1H3,(H,23,25)(H,26,27)/b6-5+/t15-,17-,18+,19+/m1/s1
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n/an/a 8.00E+3n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Geranylgeranyl transferase in the geranylgeranylation of H-ras-CAIL protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein farnesyltransferase beta/geranylgeranyltransferase type I alpha subunit


(Mus musculus)
BDBM50366604
PNG
(CHEMBL1793800 | CHEMBL3349311)
Show SMILES OC(=O)C(F)(F)F.OC(=O)C(F)(F)F.CCCc1ccccc1O[C@H]1C[C@@H](N(C\C=C\[C@@H](N)CS)C1)C(=O)N[C@H](CCSC)C(=O)OC
Show InChI InChI=1S/C25H39N3O4S2/c1-4-8-18-9-5-6-11-23(18)32-20-15-22(28(16-20)13-7-10-19(26)17-33)24(29)27-21(12-14-34-3)25(30)31-2/h5-7,9-11,19-22,33H,4,8,12-17,26H2,1-3H3,(H,27,29)/t19-,20+,21-,22-/m1/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration against Farnesyltransferase for Farnesylation of H-ras protein InNIH 3T3 cells transformed with activated H-ras


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein farnesyltransferase beta/geranylgeranyltransferase type I alpha subunit


(Mus musculus)
BDBM50216998
PNG
(CHEMBL3349356)
Show SMILES OC(=O)C(F)(F)F.OC(=O)C(F)(F)F.COC(=O)[C@H](CCSC)NC(=O)[C@@H]1C[C@@H](CN1C\C=C\C(N)CS)Oc1cccc2CCCCc12
Show InChI InChI=1S/C26H39N3O4S2.2C2HF3O2/c1-32-26(31)22(12-14-35-2)28-25(30)23-15-20(16-29(23)13-6-9-19(27)17-34)33-24-11-5-8-18-7-3-4-10-21(18)24;2*3-2(4,5)1(6)7/h5-6,8-9,11,19-20,22-23,34H,3-4,7,10,12-17,27H2,1-2H3,(H,28,30);2*(H,6,7)/b9-6+;;/t19?,20-,22-,23-;;/m0../s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration against Farnesyltransferase for Farnesylation of H-ras protein InNIH 3T3 cells transformed with activated H-ras


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Geranylgeranyl Transferase (GGTase-I)


(Bos taurus (bovine))
BDBM50403713
PNG
(CHEMBL2092731)
Show SMILES CSCC[C@@H](NC(=O)[C@H]1C[C@@H](CN1C\C=C\[C@@H](N)CS)Oc1ccccc1)C(O)=O
Show InChI InChI=1S/C21H31N3O4S2/c1-30-11-9-18(21(26)27)23-20(25)19-12-17(28-16-7-3-2-4-8-16)13-24(19)10-5-6-15(22)14-29/h2-8,15,17-19,29H,9-14,22H2,1H3,(H,23,25)(H,26,27)/b6-5+/t15-,17+,18-,19-/m1/s1
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n/an/a 1.10E+4n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Geranylgeranyl transferase in the geranylgeranylation of H-ras-CAIL protein


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein farnesyltransferase beta/geranylgeranyltransferase type I alpha subunit


(Mus musculus)
BDBM50216997
PNG
(CHEMBL3349355)
Show SMILES OC(=O)C(F)(F)F.OC(=O)C(F)(F)F.COC(=O)[C@H](CCSC)NC(=O)[C@@H]1C[C@@H](CN1C\C=C\C(N)CS)Oc1cccc2ccccc12
Show InChI InChI=1S/C26H35N3O4S2.2C2HF3O2/c1-32-26(31)22(12-14-35-2)28-25(30)23-15-20(16-29(23)13-6-9-19(27)17-34)33-24-11-5-8-18-7-3-4-10-21(18)24;2*3-2(4,5)1(6)7/h3-11,19-20,22-23,34H,12-17,27H2,1-2H3,(H,28,30);2*(H,6,7)/b9-6+;;/t19?,20-,22-,23-;;/m0../s1
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n/an/a 2.25E+4n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration against Farnesyltransferase for Farnesylation of H-ras protein InNIH 3T3 cells transformed with activated H-ras


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein farnesyltransferase beta/geranylgeranyltransferase type I alpha subunit


(Mus musculus)
BDBM50216996
PNG
(CHEMBL3350225)
Show SMILES OC(=O)C(F)(F)F.OC(=O)C(F)(F)F.COC(=O)[C@H](CCSC)NC(=O)[C@H]1C[C@@H](CN1C\C=C\[C@@H](N)CS)Oc1ccccc1
Show InChI InChI=1S/C22H33N3O4S2.2C2HF3O2/c1-28-22(27)19(10-12-31-2)24-21(26)20-13-18(29-17-8-4-3-5-9-17)14-25(20)11-6-7-16(23)15-30;2*3-2(4,5)1(6)7/h3-9,16,18-20,30H,10-15,23H2,1-2H3,(H,24,26);2*(H,6,7)/b7-6+;;/t16-,18+,19+,20-;;/m1../s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration against Farnesyltransferase for Farnesylation of H-ras protein InNIH 3T3 cells transformed with activated H-ras


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein farnesyltransferase beta/geranylgeranyltransferase type I alpha subunit


(Mus musculus)
BDBM50079789
PNG
(CHEMBL304680 | methyl 2-[1-[4-amino-5-sulfanyl-(E,...)
Show SMILES COC(=O)[C@H](CCSC)NC(=O)[C@@H]1C[C@@H](CN1C\C=C\[C@@H](N)CS)Oc1ccc(OC)c(OC)c1
Show InChI InChI=1S/C24H37N3O6S2/c1-30-21-8-7-17(13-22(21)31-2)33-18-12-20(27(14-18)10-5-6-16(25)15-34)23(28)26-19(9-11-35-4)24(29)32-3/h5-8,13,16,18-20,34H,9-12,14-15,25H2,1-4H3,(H,26,28)/b6-5+/t16-,18+,19+,20+/m1/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration against Farnesyltransferase for Farnesylation of H-ras protein InNIH 3T3 cells transformed with activated H-ras


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein farnesyltransferase beta/geranylgeranyltransferase type I alpha subunit


(Mus musculus)
BDBM50079807
PNG
(CHEMBL294277 | methyl 2-[1-[4-amino-5-sulfanyl-(E,...)
Show SMILES COC(=O)[C@H](CCSC)NC(=O)[C@@H]1C[C@@H](CN1C\C=C\[C@@H](N)CS)Oc1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C23H32F3N3O4S2/c1-32-22(31)19(9-11-35-2)28-21(30)20-12-18(13-29(20)10-3-4-16(27)14-34)33-17-7-5-15(6-8-17)23(24,25)26/h3-8,16,18-20,34H,9-14,27H2,1-2H3,(H,28,30)/b4-3+/t16-,18+,19+,20+/m1/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration against Farnesyltransferase for Farnesylation of H-ras protein InNIH 3T3 cells transformed with activated H-ras


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Protein farnesyltransferase beta/geranylgeranyltransferase type I alpha subunit


(Mus musculus)
BDBM50403714
PNG
(CHEMBL2092854 | CHEMBL3350681)
Show SMILES OC(=O)C(F)(F)F.OC(=O)C(F)(F)F.COC(=O)[C@H](CCSC)NC(=O)[C@@H]1C[C@H](CN1C\C=C\[C@@H](N)CS)Oc1ccccc1
Show InChI InChI=1S/C22H33N3O4S2/c1-28-22(27)19(10-12-31-2)24-21(26)20-13-18(29-17-8-4-3-5-9-17)14-25(20)11-6-7-16(23)15-30/h3-9,16,18-20,30H,10-15,23H2,1-2H3,(H,24,26)/b7-6+/t16-,18-,19-,20+/m1/s1
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n/an/a>5.00E+4n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration against Farnesyltransferase for Farnesylation of H-ras protein InNIH 3T3 cells transformed with activated H-ras


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
Geranylgeranyl Transferase (GGTase-I)


(Bos taurus (bovine))
BDBM50366603
PNG
(CHEMBL1793799 | CHEMBL3349310)
Show SMILES OC(=O)C(F)(F)F.OC(=O)C(F)(F)F.COc1ccc(O[C@H]2C[C@@H](N(C\C=C\[C@@H](N)CS)C2)C(=O)N[C@H](CCSC)C(O)=O)cc1OC
Show InChI InChI=1S/C23H35N3O6S2/c1-30-20-7-6-16(12-21(20)31-2)32-17-11-19(26(13-17)9-4-5-15(24)14-33)22(27)25-18(23(28)29)8-10-34-3/h4-7,12,15,17-19,33H,8-11,13-14,24H2,1-3H3,(H,25,27)(H,28,29)/t15-,17+,18-,19-/m1/s1
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n/an/a 6.70E+4n/an/an/an/an/an/a



Eisai Research Institute

Curated by ChEMBL


Assay Description
Inhibitory concentration against Farnesyltransferase for Farnesylation of H-ras protein InNIH 3T3 cells transformed with activated H-ras


Bioorg Med Chem Lett 9: 2095-100 (1999)


Article DOI: 10.1016/s0960-894x(99)00342-x
BindingDB Entry DOI: 10.7270/Q2Z038PQ
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%