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PubMed code 26962429

Compile data set for download or QSAR
Found 15 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
Glycylpeptide N-tetradecanoyltransferase 1


(Homo sapiens (Human))
BDBM50148269
PNG
(CHEMBL3770219)
Show SMILES Cc1nn(C)c(C)c1Cc1nnc(o1)-c1cc(Cl)ccc1OC1CCNCC1
Show InChI InChI=1S/C20H24ClN5O2/c1-12-16(13(2)26(3)25-12)11-19-23-24-20(28-19)17-10-14(21)4-5-18(17)27-15-6-8-22-9-7-15/h4-5,10,15,22H,6-9,11H2,1-3H3
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PubMed
20n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Binding affinity to human N-myristoyltransferase by fluorescence analysis


Medchemcomm 6: 1761-1766 (2016)


BindingDB Entry DOI: 10.7270/Q2TB18R2
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1


(Homo sapiens (Human))
BDBM50148267
PNG
(CHEMBL3770442)
Show SMILES COc1cccc(Cc2noc(n2)-c2cc(Cl)ccc2OC2CCNCC2)c1
Show InChI InChI=1S/C21H22ClN3O3/c1-26-17-4-2-3-14(11-17)12-20-24-21(28-25-20)18-13-15(22)5-6-19(18)27-16-7-9-23-10-8-16/h2-6,11,13,16,23H,7-10,12H2,1H3
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70n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Binding affinity to human N-myristoyltransferase by fluorescence analysis


Medchemcomm 6: 1761-1766 (2016)


BindingDB Entry DOI: 10.7270/Q2TB18R2
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1


(Homo sapiens (Human))
BDBM50148265
PNG
(CHEMBL3770815)
Show SMILES COc1cccc(Cc2noc(n2)-c2ccc(Br)cc2OC2CCNCC2)c1
Show InChI InChI=1S/C21H22BrN3O3/c1-26-17-4-2-3-14(11-17)12-20-24-21(28-25-20)18-6-5-15(22)13-19(18)27-16-7-9-23-10-8-16/h2-6,11,13,16,23H,7-10,12H2,1H3
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260n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Binding affinity to human N-myristoyltransferase by fluorescence analysis


Medchemcomm 6: 1761-1766 (2016)


BindingDB Entry DOI: 10.7270/Q2TB18R2
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1


(Homo sapiens (Human))
BDBM50135531
PNG
(CHEMBL3753053)
Show SMILES COc1cccc(Cc2noc(n2)-c2ccc(Cl)cc2OC2CCNCC2)c1
Show InChI InChI=1S/C21H22ClN3O3/c1-26-17-4-2-3-14(11-17)12-20-24-21(28-25-20)18-6-5-15(22)13-19(18)27-16-7-9-23-10-8-16/h2-6,11,13,16,23H,7-10,12H2,1H3
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450n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Binding affinity to human N-myristoyltransferase by fluorescence analysis


Medchemcomm 6: 1761-1766 (2016)


BindingDB Entry DOI: 10.7270/Q2TB18R2
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1


(Homo sapiens (Human))
BDBM50135701
PNG
(CHEMBL3754641)
Show SMILES COc1cccc(Cc2noc(n2)-c2ccc(F)cc2OC2CCNCC2)c1
Show InChI InChI=1S/C12H21N2O/c1-11(2)14(3,4)8-9-15-12-6-5-7-13-10-12/h5-7,10-11H,8-9H2,1-4H3/q+1
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590n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Binding affinity to human N-myristoyltransferase by fluorescence analysis


Medchemcomm 6: 1761-1766 (2016)


BindingDB Entry DOI: 10.7270/Q2TB18R2
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1


(Homo sapiens (Human))
BDBM50148266
PNG
(CHEMBL3770262)
Show SMILES COc1cccc(Cc2noc(n2)-c2cc(C)ccc2OC2CCNCC2)c1
Show InChI InChI=1S/C22H25N3O3/c1-15-6-7-20(27-17-8-10-23-11-9-17)19(12-15)22-24-21(25-28-22)14-16-4-3-5-18(13-16)26-2/h3-7,12-13,17,23H,8-11,14H2,1-2H3
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760n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Binding affinity to human N-myristoyltransferase by fluorescence analysis


Medchemcomm 6: 1761-1766 (2016)


BindingDB Entry DOI: 10.7270/Q2TB18R2
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1


(Homo sapiens (Human))
BDBM50148268
PNG
(CHEMBL3771033)
Show SMILES COc1cccc(Cc2noc(n2)-c2cc(OC)ccc2OC2CCNCC2)c1
Show InChI InChI=1S/C22H25N3O4/c1-26-17-5-3-4-15(12-17)13-21-24-22(29-25-21)19-14-18(27-2)6-7-20(19)28-16-8-10-23-11-9-16/h3-7,12,14,16,23H,8-11,13H2,1-2H3
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760n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Binding affinity to human N-myristoyltransferase by fluorescence analysis


Medchemcomm 6: 1761-1766 (2016)


BindingDB Entry DOI: 10.7270/Q2TB18R2
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1


(Homo sapiens (Human))
BDBM50135702
PNG
(CHEMBL3753483)
Show SMILES COc1cccc(Cc2noc(n2)-c2ccc(OC)cc2OC2CCNCC2)c1
Show InChI InChI=1S/C12H21N2O/c1-4-8-14(2,3)9-10-15-12-6-5-7-13-11-12/h5-7,11H,4,8-10H2,1-3H3/q+1
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860n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Binding affinity to human N-myristoyltransferase by fluorescence analysis


Medchemcomm 6: 1761-1766 (2016)


BindingDB Entry DOI: 10.7270/Q2TB18R2
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1


(Homo sapiens (Human))
BDBM50135481
PNG
(CHEMBL3754110)
Show SMILES COc1cccc(Cc2noc(n2)-c2ccccc2OC2CCNCC2)c1
Show InChI InChI=1S/C21H23N3O3/c1-25-17-6-4-5-15(13-17)14-20-23-21(27-24-20)18-7-2-3-8-19(18)26-16-9-11-22-12-10-16/h2-8,13,16,22H,9-12,14H2,1H3
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1.24E+3n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Binding affinity to human N-myristoyltransferase by fluorescence analysis


Medchemcomm 6: 1761-1766 (2016)


BindingDB Entry DOI: 10.7270/Q2TB18R2
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1


(Homo sapiens (Human))
BDBM50423890
PNG
(CHEMBL2312449)
Show SMILES COc1cccc(COC(=O)c2sc3ccccc3c2OC2CCNCC2)c1
Show InChI InChI=1S/C22H23NO4S/c1-25-17-6-4-5-15(13-17)14-26-22(24)21-20(27-16-9-11-23-12-10-16)18-7-2-3-8-19(18)28-21/h2-8,13,16,23H,9-12,14H2,1H3
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3.20E+3n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Binding affinity to human N-myristoyltransferase by fluorescence analysis


Medchemcomm 6: 1761-1766 (2016)


BindingDB Entry DOI: 10.7270/Q2TB18R2
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1


(Homo sapiens (Human))
BDBM50148264
PNG
(CHEMBL3771337)
Show SMILES COc1cccc(Cc2noc(n2)-c2ccc(C)cc2OC2CCNCC2)c1
Show InChI InChI=1S/C22H25N3O3/c1-15-6-7-19(20(12-15)27-17-8-10-23-11-9-17)22-24-21(25-28-22)14-16-4-3-5-18(13-16)26-2/h3-7,12-13,17,23H,8-11,14H2,1-2H3
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4.64E+3n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Binding affinity to human N-myristoyltransferase by fluorescence analysis


Medchemcomm 6: 1761-1766 (2016)


BindingDB Entry DOI: 10.7270/Q2TB18R2
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1


(Homo sapiens (Human))
BDBM50148262
PNG
(CHEMBL3770859)
Show SMILES COc1cccc(Cc2noc(n2)-c2cccc(OC)c2OC2CCNCC2)c1
Show InChI InChI=1S/C22H25N3O4/c1-26-17-6-3-5-15(13-17)14-20-24-22(29-25-20)18-7-4-8-19(27-2)21(18)28-16-9-11-23-12-10-16/h3-8,13,16,23H,9-12,14H2,1-2H3
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7.23E+3n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Binding affinity to human N-myristoyltransferase by fluorescence analysis


Medchemcomm 6: 1761-1766 (2016)


BindingDB Entry DOI: 10.7270/Q2TB18R2
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1


(Homo sapiens (Human))
BDBM50148263
PNG
(CHEMBL3770880)
Show SMILES COc1cccc(Cc2noc(n2)-c2cccc(C)c2OC2CCNCC2)c1
Show InChI InChI=1S/C22H25N3O3/c1-15-5-3-8-19(21(15)27-17-9-11-23-12-10-17)22-24-20(25-28-22)14-16-6-4-7-18(13-16)26-2/h3-8,13,17,23H,9-12,14H2,1-2H3
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7.44E+3n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Binding affinity to human N-myristoyltransferase by fluorescence analysis


Medchemcomm 6: 1761-1766 (2016)


BindingDB Entry DOI: 10.7270/Q2TB18R2
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1


(Homo sapiens (Human))
BDBM50148261
PNG
(CHEMBL3770301)
Show SMILES COc1cccc(COC(=O)c2ccccc2OC2CCNCC2)c1
Show InChI InChI=1S/C20H23NO4/c1-23-17-6-4-5-15(13-17)14-24-20(22)18-7-2-3-8-19(18)25-16-9-11-21-12-10-16/h2-8,13,16,21H,9-12,14H2,1H3
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>1.00E+5n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Binding affinity to human N-myristoyltransferase by fluorescence analysis


Medchemcomm 6: 1761-1766 (2016)


BindingDB Entry DOI: 10.7270/Q2TB18R2
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1


(Homo sapiens (Human))
BDBM50148260
PNG
(CHEMBL3770735)
Show SMILES COc1cccc(COC(=O)c2sccc2OC2CCNCC2)c1
Show InChI InChI=1S/C18H21NO4S/c1-21-15-4-2-3-13(11-15)12-22-18(20)17-16(7-10-24-17)23-14-5-8-19-9-6-14/h2-4,7,10-11,14,19H,5-6,8-9,12H2,1H3
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>1.00E+5n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Binding affinity to human N-myristoyltransferase by fluorescence analysis


Medchemcomm 6: 1761-1766 (2016)


BindingDB Entry DOI: 10.7270/Q2TB18R2
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%