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PubMed code 12699746

Compile data set for download or QSAR
Found 7 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
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50127228
PNG
(2-({6-[(2-Mercapto-ethylamino)-methyl]-4-naphthale...)
Show SMILES SCCNCc1cc(cc(CNCCS)n1)-c1cccc2ccccc12
Show InChI InChI=1S/C21H25N3S2/c25-10-8-22-14-18-12-17(13-19(24-18)15-23-9-11-26)21-7-3-5-16-4-1-2-6-20(16)21/h1-7,12-13,22-23,25-26H,8-11,14-15H2
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PubMed
n/an/a 1.90E+3n/an/an/an/an/an/a



Kumamoto University

Curated by ChEMBL


Assay Description
Inhibition of [3H]-farnesyl pyrophosphate binding to human farnesyltransferase


Bioorg Med Chem Lett 13: 1523-6 (2003)


BindingDB Entry DOI: 10.7270/Q2QZ29BR
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM14454
PNG
(1-(4-pyridylacetyl)-4-(8-chloro-5,6-dihydro-11H-be...)
Show SMILES Clc1ccc2c(-[#6]-[#6]-c3cccnc3\[#6]-2=[#6]-2\[#6]-[#6]-[#7](-[#6]-[#6]-2)-[#6](=O)-[#6]-c2ccncc2)c1
Show InChI InChI=1S/C26H24ClN3O/c27-22-5-6-23-21(17-22)4-3-20-2-1-11-29-26(20)25(23)19-9-14-30(15-10-19)24(31)16-18-7-12-28-13-8-18/h1-2,5-8,11-13,17H,3-4,9-10,14-16H2
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PubMed
n/an/a 2.50E+3n/an/an/an/an/an/a



Kumamoto University

Curated by ChEMBL


Assay Description
Inhibition of [3H]-farnesyl pyrophosphate binding to human farnesyltransferase


Bioorg Med Chem Lett 13: 1523-6 (2003)


BindingDB Entry DOI: 10.7270/Q2QZ29BR
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50127227
PNG
((R)-2,4,6-Trimethyl-deca-2,4-dienoic acid {(1S,5S,...)
Show SMILES CCCC[C@@H](C)C=C(C)C=C(C)C(=O)NC1=C[C@@](O)(\C=C\C=CC=CC(=O)NC2C(=O)CCC2=O)[C@@H]2O[C@@H]2C1=O |r,w:23.22,9.8,7.7,21.20,t:15|
Show InChI InChI=1S/C31H38N2O7/c1-5-6-11-19(2)16-20(3)17-21(4)30(38)32-22-18-31(39,29-28(40-29)27(22)37)15-10-8-7-9-12-25(36)33-26-23(34)13-14-24(26)35/h7-10,12,15-19,26,28-29,39H,5-6,11,13-14H2,1-4H3,(H,32,38)(H,33,36)/b8-7?,12-9?,15-10+,20-16?,21-17?/t19-,28-,29-,31+/m1/s1
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n/an/a 1.19E+4n/an/an/an/an/an/a



Kumamoto University

Curated by ChEMBL


Assay Description
Inhibition of [3H]-farnesyl pyrophosphate binding to human farnesyltransferase


Bioorg Med Chem Lett 13: 1523-6 (2003)


BindingDB Entry DOI: 10.7270/Q2QZ29BR
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50127226
PNG
(2-({4-Dimethylamino-6-[(2-mercapto-ethylamino)-met...)
Show SMILES CN(C)c1cc(CNCCS)nc(CNCCS)c1
Show InChI InChI=1S/C13H24N4S2/c1-17(2)13-7-11(9-14-3-5-18)16-12(8-13)10-15-4-6-19/h7-8,14-15,18-19H,3-6,9-10H2,1-2H3
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n/an/a 6.20E+5n/an/an/an/an/an/a



Kumamoto University

Curated by ChEMBL


Assay Description
Inhibition of [3H]-farnesyl pyrophosphate binding to human farnesyltransferase


Bioorg Med Chem Lett 13: 1523-6 (2003)


BindingDB Entry DOI: 10.7270/Q2QZ29BR
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50092158
PNG
(1,10-phenanthroline | CHEMBL415879 | US10669227, C...)
Show SMILES c1cnc2c(c1)ccc1cccnc21
Show InChI InChI=1S/C12H8N2/c1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1/h1-8H
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n/an/a 4.00E+6n/an/an/an/an/an/a



Kumamoto University

Curated by ChEMBL


Assay Description
Inhibition of [3H]-farnesyl pyrophosphate binding to human farnesyltransferase


Bioorg Med Chem Lett 13: 1523-6 (2003)


BindingDB Entry DOI: 10.7270/Q2QZ29BR
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM7972
PNG
(CHEMBL816 | ethane-1,2-diamine | ethylenediamine)
Show InChI InChI=1S/C2H8N2/c3-1-2-4/h1-4H2
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n/an/a 1.55E+7n/an/an/an/an/an/a



Kumamoto University

Curated by ChEMBL


Assay Description
Inhibition of [3H]-farnesyl pyrophosphate binding to human farnesyltransferase


Bioorg Med Chem Lett 13: 1523-6 (2003)


BindingDB Entry DOI: 10.7270/Q2QZ29BR
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50042874
PNG
(2,2'-Bipyridin | 2,2'-bipyridine | 2,2'-bipyridyl ...)
Show SMILES c1ccc(nc1)-c1ccccn1
Show InChI InChI=1S/C10H8N2/c1-3-7-11-9(5-1)10-6-2-4-8-12-10/h1-8H
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PubMed
n/an/a 1.00E+8n/an/an/an/an/an/a



Kumamoto University

Curated by ChEMBL


Assay Description
Inhibition of [3H]-farnesyl pyrophosphate binding to human farnesyltransferase


Bioorg Med Chem Lett 13: 1523-6 (2003)


BindingDB Entry DOI: 10.7270/Q2QZ29BR
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%