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Compile Data Set for Download or QSAR

Found 179 hits of ic50 for UniProtKB: P30419   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50121716
PNG
((3-methyl-4-(3-(pyridin-3-ylmethylamino)propoxy)be...)
Show SMILES Cc1c(oc2cccc(OCCCNCc3cccnc3)c12)C(=O)c1ccc(C)cn1
Show InChI InChI=1S/C25H25N3O3/c1-17-9-10-20(28-14-17)24(29)25-18(2)23-21(7-3-8-22(23)31-25)30-13-5-12-27-16-19-6-4-11-26-15-19/h3-4,6-11,14-15,27H,5,12-13,16H2,1-2H3
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n/an/a 0.390n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against candida albicans Nmt (CaNmt) using substrate peptide GLTISKLFR-R-NH2 (0.5 uM) and myristoyl-CoA (0.5 uM)


Bioorg Med Chem Lett 13: 87-91 (2003)


BindingDB Entry DOI: 10.7270/Q25D8V2K
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50220561
PNG
(CHEMBL173370)
Show SMILES Cc1c(oc2cccc(OCCCNCc3cccnc3)c12)C(=O)c1nc2ccccc2n1C
Show InChI InChI=1S/C27H26N4O3/c1-18-24-22(33-15-7-14-29-17-19-8-6-13-28-16-19)11-5-12-23(24)34-26(18)25(32)27-30-20-9-3-4-10-21(20)31(27)2/h3-6,8-13,16,29H,7,14-15,17H2,1-2H3
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n/an/a 0.400n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Candida albicans Nmt (CaNmt) using substrate peptide GLTISKLFR-R-NH2 (0.5 uM) and myristoyl-CoA (0.5 uM)


Bioorg Med Chem Lett 13: 87-91 (2003)


BindingDB Entry DOI: 10.7270/Q25D8V2K
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50220562
PNG
(CHEMBL171506)
Show SMILES Cc1c(oc2cccc(OCCCNCc3cccnc3)c12)C(=O)c1nc2ccccc2n1CC=C
Show InChI InChI=1S/C29H28N4O3/c1-3-16-33-23-11-5-4-10-22(23)32-29(33)27(34)28-20(2)26-24(12-6-13-25(26)36-28)35-17-8-15-31-19-21-9-7-14-30-18-21/h3-7,9-14,18,31H,1,8,15-17,19H2,2H3
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n/an/a 0.580n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Candida albicans Nmt (CaNmt) using substrate peptide GLTISKLFR-R-NH2 (0.5 uM) and myristoyl-CoA (0.5 uM)


Bioorg Med Chem Lett 13: 87-91 (2003)


BindingDB Entry DOI: 10.7270/Q25D8V2K
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50220565
PNG
(CHEMBL170524)
Show SMILES Cc1nc(sc1C)C(=O)c1oc2cccc(OCCCNCc3cccnc3)c2c1C
Show InChI InChI=1S/C24H25N3O3S/c1-15-21-19(29-12-6-11-26-14-18-7-5-10-25-13-18)8-4-9-20(21)30-23(15)22(28)24-27-16(2)17(3)31-24/h4-5,7-10,13,26H,6,11-12,14H2,1-3H3
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n/an/a 0.710n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Candida albicans Nmt (CaNmt) using substrate peptide GLTISKLFR-R-NH2 (0.5 uM) and myristoyl-CoA (0.5 uM)


Bioorg Med Chem Lett 13: 87-91 (2003)


BindingDB Entry DOI: 10.7270/Q25D8V2K
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50220569
PNG
(CHEMBL422896)
Show SMILES CC(C)n1c(nc2ccccc12)C(=O)c1oc2cccc(OCCCNCc3cccnc3)c2c1C
Show InChI InChI=1S/C29H30N4O3/c1-19(2)33-23-11-5-4-10-22(23)32-29(33)27(34)28-20(3)26-24(12-6-13-25(26)36-28)35-16-8-15-31-18-21-9-7-14-30-17-21/h4-7,9-14,17,19,31H,8,15-16,18H2,1-3H3
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n/an/a 1.30n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Candida albicans Nmt (CaNmt) using substrate peptide GLTISKLFR-R-NH2 (0.5 uM) and myristoyl-CoA (0.5 uM)


Bioorg Med Chem Lett 13: 87-91 (2003)


BindingDB Entry DOI: 10.7270/Q25D8V2K
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50121720
PNG
((1-METHYL-1H-IMIDAZOL-2-YL)-(3-METHYL-4-{3-[(PYRID...)
Show SMILES Cc1c(oc2cccc(OCCCNCc3cccnc3)c12)C(=O)c1nccn1C
Show InChI InChI=1S/C23H24N4O3/c1-16-20-18(29-13-5-10-25-15-17-6-4-9-24-14-17)7-3-8-19(20)30-22(16)21(28)23-26-11-12-27(23)2/h3-4,6-9,11-12,14,25H,5,10,13,15H2,1-2H3
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n/an/a 1.30n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Candida albicans Nmt (CaNmt) using substrate peptide GLTISKLFR-R-NH2 (0.5 uM) and myristoyl-CoA (0.5 uM)


Bioorg Med Chem Lett 13: 87-91 (2003)


BindingDB Entry DOI: 10.7270/Q25D8V2K
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50220559
PNG
(CHEMBL422746)
Show SMILES Cc1csc(n1)C(=O)c1oc2cccc(OCCCNCc3cccnc3)c2c1C
Show InChI InChI=1S/C23H23N3O3S/c1-15-14-30-23(26-15)21(27)22-16(2)20-18(7-3-8-19(20)29-22)28-11-5-10-25-13-17-6-4-9-24-12-17/h3-4,6-9,12,14,25H,5,10-11,13H2,1-2H3
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n/an/a 2n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Candida albicans Nmt (CaNmt) using substrate peptide GLTISKLFR-R-NH2 (0.5 uM) and myristoyl-CoA (0.5 uM)


Bioorg Med Chem Lett 13: 87-91 (2003)


BindingDB Entry DOI: 10.7270/Q25D8V2K
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50220571
PNG
(CHEMBL355250)
Show SMILES Cc1c(oc2cccc(OCCCNCc3cccnc3)c12)C(=O)c1ccccn1
Show InChI InChI=1S/C24H23N3O3/c1-17-22-20(29-14-6-12-26-16-18-7-5-11-25-15-18)9-4-10-21(22)30-24(17)23(28)19-8-2-3-13-27-19/h2-5,7-11,13,15,26H,6,12,14,16H2,1H3
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n/an/a 3.5n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Candida albicans Nmt (CaNmt) using substrate peptide GLTISKLFR-R-NH2 (0.5 uM) and myristoyl-CoA (0.5 uM)


Bioorg Med Chem Lett 13: 87-91 (2003)


BindingDB Entry DOI: 10.7270/Q25D8V2K
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50219305
PNG
(CHEMBL347895)
Show SMILES Cc1c(COc2ccccc2F)oc2cccc(OCCCNCc3cccnc3)c12
Show InChI InChI=1S/C25H25FN2O3/c1-18-24(17-30-21-9-3-2-8-20(21)26)31-23-11-4-10-22(25(18)23)29-14-6-13-28-16-19-7-5-12-27-15-19/h2-5,7-12,15,28H,6,13-14,16-17H2,1H3
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n/an/a 3.70n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
Inhibitory activity against Candida albicans (Nmt) assessed as inhibitory concentration


Bioorg Med Chem Lett 12: 607-10 (2002)


BindingDB Entry DOI: 10.7270/Q2PC34K1
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50219303
PNG
(CHEMBL345893)
Show SMILES Cc1c(COc2ccc(F)cc2F)oc2cccc(OCCCNCc3cccnc3)c12
Show InChI InChI=1S/C25H24F2N2O3/c1-17-24(16-31-21-9-8-19(26)13-20(21)27)32-23-7-2-6-22(25(17)23)30-12-4-11-29-15-18-5-3-10-28-14-18/h2-3,5-10,13-14,29H,4,11-12,15-16H2,1H3
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n/an/a 3.70n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
Inhibitory activity against Candida albicans (Nmt) assessed as inhibitory concentration (nM)


Bioorg Med Chem Lett 12: 607-10 (2002)


BindingDB Entry DOI: 10.7270/Q2PC34K1
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50219312
PNG
(CHEMBL158172)
Show SMILES Cc1c(COc2ccc(F)cc2)oc2cccc(OCCCNCc3cccnc3)c12
Show InChI InChI=1S/C25H25FN2O3/c1-18-24(17-30-21-10-8-20(26)9-11-21)31-23-7-2-6-22(25(18)23)29-14-4-13-28-16-19-5-3-12-27-15-19/h2-3,5-12,15,28H,4,13-14,16-17H2,1H3
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n/an/a 3.70n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
Inhibitory activity against Candida albicans (Nmt) assessed as inhibitory concentration (nM)


Bioorg Med Chem Lett 12: 607-10 (2002)


BindingDB Entry DOI: 10.7270/Q2PC34K1
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50109879
PNG
(CHEMBL155301 | Non peptidic, 4 | {3-[2-(2,3-Difluo...)
Show SMILES Cc1c(COc2cccc(F)c2F)oc2cccc(OCCCNCc3cccnc3)c12
Show InChI InChI=1S/C25H24F2N2O3/c1-17-23(16-31-22-10-2-7-19(26)25(22)27)32-21-9-3-8-20(24(17)21)30-13-5-12-29-15-18-6-4-11-28-14-18/h2-4,6-11,14,29H,5,12-13,15-16H2,1H3
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n/an/a 3.70n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
Inhibitory activity against Candida albicans (Nmt) assessed as inhibitory concentration (nM)


Bioorg Med Chem Lett 12: 607-10 (2002)


BindingDB Entry DOI: 10.7270/Q2PC34K1
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50219310
PNG
(CHEMBL155469)
Show SMILES Cc1c(COc2ccc(cc2)C#N)oc2cccc(OCCCNCc3cccnc3)c12
Show InChI InChI=1S/C26H25N3O3/c1-19-25(18-31-22-10-8-20(15-27)9-11-22)32-24-7-2-6-23(26(19)24)30-14-4-13-29-17-21-5-3-12-28-16-21/h2-3,5-12,16,29H,4,13-14,17-18H2,1H3
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n/an/a 3.70n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
Inhibitory activity against Candida albicans N-Myristoyltransferase (Nmt)


Bioorg Med Chem Lett 12: 607-10 (2002)


BindingDB Entry DOI: 10.7270/Q2PC34K1
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50109882
PNG
(3-(3-methyl-2-((2,3,4-trifluorophenoxy)methyl)benz...)
Show SMILES Cc1c(COc2ccc(F)c(F)c2F)oc2cccc(OCCCNCc3cccnc3)c12
Show InChI InChI=1S/C25H23F3N2O3/c1-16-22(15-32-21-9-8-18(26)24(27)25(21)28)33-20-7-2-6-19(23(16)20)31-12-4-11-30-14-17-5-3-10-29-13-17/h2-3,5-10,13,30H,4,11-12,14-15H2,1H3
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n/an/a 3.70n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
Inhibitory activity against Candida albicans (Nmt) assessed as inhibitory concentration (nM); 3.7-9.4 nM


Bioorg Med Chem Lett 12: 607-10 (2002)


BindingDB Entry DOI: 10.7270/Q2PC34K1
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50109879
PNG
(CHEMBL155301 | Non peptidic, 4 | {3-[2-(2,3-Difluo...)
Show SMILES Cc1c(COc2cccc(F)c2F)oc2cccc(OCCCNCc3cccnc3)c12
Show InChI InChI=1S/C25H24F2N2O3/c1-17-23(16-31-22-10-2-7-19(26)25(22)27)32-21-9-3-8-20(24(17)21)30-13-5-12-29-15-18-6-4-11-28-14-18/h2-4,6-11,14,29H,5,12-13,15-16H2,1H3
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n/an/a 3.70n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
Inhibitory activity against Candida albicans N-Myristoyltransferase (CaNmt) assessed as inhibitory concentration using substrate peptide and myristot...


Bioorg Med Chem Lett 12: 607-10 (2002)


BindingDB Entry DOI: 10.7270/Q2PC34K1
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50219312
PNG
(CHEMBL158172)
Show SMILES Cc1c(COc2ccc(F)cc2)oc2cccc(OCCCNCc3cccnc3)c12
Show InChI InChI=1S/C25H25FN2O3/c1-18-24(17-30-21-10-8-20(26)9-11-21)31-23-7-2-6-22(25(18)23)29-14-4-13-28-16-19-5-3-12-27-15-19/h2-3,5-12,15,28H,4,13-14,16-17H2,1H3
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n/an/a 5.20n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
Inhibitory activity against Candida albicans N-Myristoyltransferase (CaNmt) assessed as inhibitory concentration using substrate peptide and myristot...


Bioorg Med Chem Lett 12: 607-10 (2002)


BindingDB Entry DOI: 10.7270/Q2PC34K1
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50109882
PNG
(3-(3-methyl-2-((2,3,4-trifluorophenoxy)methyl)benz...)
Show SMILES Cc1c(COc2ccc(F)c(F)c2F)oc2cccc(OCCCNCc3cccnc3)c12
Show InChI InChI=1S/C25H23F3N2O3/c1-16-22(15-32-21-9-8-18(26)24(27)25(21)28)33-20-7-2-6-19(23(16)20)31-12-4-11-30-14-17-5-3-10-29-13-17/h2-3,5-10,13,30H,4,11-12,14-15H2,1H3
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n/an/a 5.60n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
Inhibitory activity against Candida albicans Nmt (CaNmt)


Bioorg Med Chem Lett 13: 87-91 (2003)


BindingDB Entry DOI: 10.7270/Q25D8V2K
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50109882
PNG
(3-(3-methyl-2-((2,3,4-trifluorophenoxy)methyl)benz...)
Show SMILES Cc1c(COc2ccc(F)c(F)c2F)oc2cccc(OCCCNCc3cccnc3)c12
Show InChI InChI=1S/C25H23F3N2O3/c1-16-22(15-32-21-9-8-18(26)24(27)25(21)28)33-20-7-2-6-19(23(16)20)31-12-4-11-30-14-17-5-3-10-29-13-17/h2-3,5-10,13,30H,4,11-12,14-15H2,1H3
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n/an/a 5.70n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
Inhibitory activity against Candida albicans N-Myristoyltransferase (CaNmt) assessed as inhibitory concentration using substrate peptide and myristot...


Bioorg Med Chem Lett 12: 607-10 (2002)


BindingDB Entry DOI: 10.7270/Q2PC34K1
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50219303
PNG
(CHEMBL345893)
Show SMILES Cc1c(COc2ccc(F)cc2F)oc2cccc(OCCCNCc3cccnc3)c12
Show InChI InChI=1S/C25H24F2N2O3/c1-17-24(16-31-21-9-8-19(26)13-20(21)27)32-23-7-2-6-22(25(17)23)30-12-4-11-29-15-18-5-3-10-28-14-18/h2-3,5-10,13-14,29H,4,11-12,15-16H2,1H3
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n/an/a 7.5n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
Inhibitory activity against Candida albicans N-Myristoyltransferase (CaNmt) assessed as inhibitory concentration using substrate peptide and myristot...


Bioorg Med Chem Lett 12: 607-10 (2002)


BindingDB Entry DOI: 10.7270/Q2PC34K1
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50219305
PNG
(CHEMBL347895)
Show SMILES Cc1c(COc2ccccc2F)oc2cccc(OCCCNCc3cccnc3)c12
Show InChI InChI=1S/C25H25FN2O3/c1-18-24(17-30-21-9-3-2-8-20(21)26)31-23-11-4-10-22(25(18)23)29-14-6-13-28-16-19-7-5-12-27-15-19/h2-5,7-12,15,28H,6,13-14,16-17H2,1H3
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n/an/a 8.30n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
Inhibitory activity against Candida albicans N-Myristoyltransferase (CaNmt) assessed as inhibitory concentration using substrate peptide and myristot...


Bioorg Med Chem Lett 12: 607-10 (2002)


BindingDB Entry DOI: 10.7270/Q2PC34K1
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50219310
PNG
(CHEMBL155469)
Show SMILES Cc1c(COc2ccc(cc2)C#N)oc2cccc(OCCCNCc3cccnc3)c12
Show InChI InChI=1S/C26H25N3O3/c1-19-25(18-31-22-10-8-20(15-27)9-11-22)32-24-7-2-6-23(26(19)24)30-14-4-13-29-17-21-5-3-12-28-16-21/h2-3,5-12,16,29H,4,13-14,17-18H2,1H3
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n/an/a 9.40n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
Inhibitory activity against Candida albicans N-Myristoyltransferase (CaNmt) assessed as inhibitory concentration using substrate peptide and myristot...


Bioorg Med Chem Lett 12: 607-10 (2002)


BindingDB Entry DOI: 10.7270/Q2PC34K1
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50219308
PNG
(CHEMBL351774)
Show SMILES Cc1c(COc2ccccc2C#N)oc2cccc(OCCCNCc3cccnc3)c12
Show InChI InChI=1S/C26H25N3O3/c1-19-25(18-31-22-9-3-2-8-21(22)15-27)32-24-11-4-10-23(26(19)24)30-14-6-13-29-17-20-7-5-12-28-16-20/h2-5,7-12,16,29H,6,13-14,17-18H2,1H3
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n/an/a 17n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
Inhibitory activity against Candida albicans N-Myristoyltransferase (CaNmt) assessed as inhibitory concentration using substrate peptide and myristot...


Bioorg Med Chem Lett 12: 607-10 (2002)


BindingDB Entry DOI: 10.7270/Q2PC34K1
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50059429
PNG
((S)-6-Amino-2-[(S)-3-hydroxy-2-((R)-2-{4-[4-(2-met...)
Show SMILES C[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)NCCC1CCCCC1)c1ccc(CCCCn2ccnc2C)cc1
Show InChI InChI=1S/C34H54N6O4/c1-25(29-16-14-28(15-17-29)12-7-9-22-40-23-21-36-26(40)2)32(42)39-31(24-41)34(44)38-30(13-6-8-19-35)33(43)37-20-18-27-10-4-3-5-11-27/h14-17,21,23,25,27,30-31,41H,3-13,18-20,22,24,35H2,1-2H3,(H,37,43)(H,38,44)(H,39,42)/t25-,30+,31+/m1/s1
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n/an/a 20n/an/an/an/an/an/a



G.D. Searle and Company

Curated by ChEMBL


Assay Description
Inhibition activity against N-myristoyltransferase (NMT) of candida albicans.


J Med Chem 40: 2609-25 (1997)


Article DOI: 10.1021/jm970094w
BindingDB Entry DOI: 10.7270/Q2BR8VXS
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50219309
PNG
(CHEMBL158185)
Show SMILES Cc1c(COc2ccc(Br)cc2F)oc2cccc(OCCCNCc3cccnc3)c12
Show InChI InChI=1S/C25H24BrFN2O3/c1-17-24(16-31-21-9-8-19(26)13-20(21)27)32-23-7-2-6-22(25(17)23)30-12-4-11-29-15-18-5-3-10-28-14-18/h2-3,5-10,13-14,29H,4,11-12,15-16H2,1H3
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n/an/a 28n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
Inhibitory activity against Candida albicans N-Myristoyltransferase (CaNmt) assessed as inhibitory concentration using substrate peptide and myristot...


Bioorg Med Chem Lett 12: 607-10 (2002)


BindingDB Entry DOI: 10.7270/Q2PC34K1
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50059427
PNG
((S)-6-Amino-2-[(S)-3-hydroxy-2-(2-{4-[4-(2-methyl-...)
Show SMILES CC(C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)NCCC1CCCCC1)c1ccc(CCCCn2ccnc2C)cc1
Show InChI InChI=1S/C34H54N6O4/c1-25(29-16-14-28(15-17-29)12-7-9-22-40-23-21-36-26(40)2)32(42)39-31(24-41)34(44)38-30(13-6-8-19-35)33(43)37-20-18-27-10-4-3-5-11-27/h14-17,21,23,25,27,30-31,41H,3-13,18-20,22,24,35H2,1-2H3,(H,37,43)(H,38,44)(H,39,42)/t25?,30-,31-/m0/s1
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n/an/a 40n/an/an/an/an/an/a



G.D. Searle and Company

Curated by ChEMBL


Assay Description
Inhibition activity against N-myristoyltransferase (NMT) of candida albicans.


J Med Chem 40: 2609-25 (1997)


Article DOI: 10.1021/jm970094w
BindingDB Entry DOI: 10.7270/Q2BR8VXS
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50059419
PNG
((S)-6-Amino-2-[(S)-3-hydroxy-2-(2-{4-[4-(2-methyl-...)
Show SMILES CCC(C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)NCCC1CCCCC1)c1ccc(CCCCn2ccnc2C)cc1
Show InChI InChI=1S/C35H56N6O4/c1-3-30(29-17-15-28(16-18-29)13-8-10-23-41-24-22-37-26(41)2)33(43)40-32(25-42)35(45)39-31(14-7-9-20-36)34(44)38-21-19-27-11-5-4-6-12-27/h15-18,22,24,27,30-32,42H,3-14,19-21,23,25,36H2,1-2H3,(H,38,44)(H,39,45)(H,40,43)/t30?,31-,32-/m0/s1
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n/an/a 42n/an/an/an/an/an/a



G.D. Searle and Company

Curated by ChEMBL


Assay Description
Inhibition activity against N-myristoyltransferase (NMT) of candida albicans.


J Med Chem 40: 2609-25 (1997)


Article DOI: 10.1021/jm970094w
BindingDB Entry DOI: 10.7270/Q2BR8VXS
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50220564
PNG
(CHEMBL353541)
Show SMILES Cc1c(oc2cccc(OCCCNCc3cccnc3)c12)C(=O)c1ncccc1C(F)(F)F
Show InChI InChI=1S/C25H22F3N3O3/c1-16-21-19(33-13-5-11-30-15-17-6-3-10-29-14-17)8-2-9-20(21)34-24(16)23(32)22-18(25(26,27)28)7-4-12-31-22/h2-4,6-10,12,14,30H,5,11,13,15H2,1H3
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n/an/a 43n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Candida albicans Nmt (CaNmt) using substrate peptide GLTISKLFR-R-NH2 (0.5 uM) and myristoyl-CoA (0.5 uM)


Bioorg Med Chem Lett 13: 87-91 (2003)


BindingDB Entry DOI: 10.7270/Q25D8V2K
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50220566
PNG
(CHEMBL172471)
Show SMILES Cc1c(oc2cccc(OCCCNCc3cccnc3)c12)C(O)c1ccccn1
Show InChI InChI=1S/C24H25N3O3/c1-17-22-20(29-14-6-12-26-16-18-7-5-11-25-15-18)9-4-10-21(22)30-24(17)23(28)19-8-2-3-13-27-19/h2-5,7-11,13,15,23,26,28H,6,12,14,16H2,1H3
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n/an/a 47n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
Inhibitory activity against Candida albicans Nmt (CaNmt) using substrate peptide GLTISKLFR-R-NH2 (0.5 uM) and myristoyl-CoA (0.5 uM)


Bioorg Med Chem Lett 13: 87-91 (2003)


BindingDB Entry DOI: 10.7270/Q25D8V2K
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50034993
PNG
((S)-6-Amino-2-[(S)-3-hydroxy-2-(2-{4-[4-(2-methyl-...)
Show SMILES Cc1nccn1CCCCc1ccc(CC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)NCCC2CCCCC2)cc1
Show InChI InChI=1S/C33H52N6O4/c1-25-35-20-22-39(25)21-8-6-11-27-13-15-28(16-14-27)23-31(41)37-30(24-40)33(43)38-29(12-5-7-18-34)32(42)36-19-17-26-9-3-2-4-10-26/h13-16,20,22,26,29-30,40H,2-12,17-19,21,23-24,34H2,1H3,(H,36,42)(H,37,41)(H,38,43)/t29-,30-/m0/s1
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n/an/a 56n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Candida albicans N-myristoyltransferase (NMT) with peptide GNAASARR-NH2 and [3H]myristoyl-CoA at 1 uM


Citation and Details

BindingDB Entry DOI: 10.7270/Q2FJ2JXN
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50034993
PNG
((S)-6-Amino-2-[(S)-3-hydroxy-2-(2-{4-[4-(2-methyl-...)
Show SMILES Cc1nccn1CCCCc1ccc(CC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)NCCC2CCCCC2)cc1
Show InChI InChI=1S/C33H52N6O4/c1-25-35-20-22-39(25)21-8-6-11-27-13-15-28(16-14-27)23-31(41)37-30(24-40)33(43)38-29(12-5-7-18-34)32(42)36-19-17-26-9-3-2-4-10-26/h13-16,20,22,26,29-30,40H,2-12,17-19,21,23-24,34H2,1H3,(H,36,42)(H,37,41)(H,38,43)/t29-,30-/m0/s1
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n/an/a 56n/an/an/an/an/an/a



G.D. Searle and Company

Curated by ChEMBL


Assay Description
Inhibition activity against N-myristoyltransferase (NMT) of candida albicans.


J Med Chem 40: 2609-25 (1997)


Article DOI: 10.1021/jm970094w
BindingDB Entry DOI: 10.7270/Q2BR8VXS
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50034993
PNG
((S)-6-Amino-2-[(S)-3-hydroxy-2-(2-{4-[4-(2-methyl-...)
Show SMILES Cc1nccn1CCCCc1ccc(CC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)NCCC2CCCCC2)cc1
Show InChI InChI=1S/C33H52N6O4/c1-25-35-20-22-39(25)21-8-6-11-27-13-15-28(16-14-27)23-31(41)37-30(24-40)33(43)38-29(12-5-7-18-34)32(42)36-19-17-26-9-3-2-4-10-26/h13-16,20,22,26,29-30,40H,2-12,17-19,21,23-24,34H2,1H3,(H,36,42)(H,37,41)(H,38,43)/t29-,30-/m0/s1
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n/an/a 56n/an/an/an/an/an/a



G.D. Searle and Co.

Curated by ChEMBL


Assay Description
Inhibitory activity against Candida albicans N-Myristoyltransferase (NMT).


J Med Chem 38: 1837-40 (1995)


Article DOI: 10.1021/jm00011a001
BindingDB Entry DOI: 10.7270/Q23J3GPZ
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50220563
PNG
(CHEMBL353249)
Show SMILES Cc1c(oc2cccc(OCCCNCc3cccnc3)c12)C(=O)c1cccnc1
Show InChI InChI=1S/C24H23N3O3/c1-17-22-20(29-13-5-12-26-15-18-6-3-10-25-14-18)8-2-9-21(22)30-24(17)23(28)19-7-4-11-27-16-19/h2-4,6-11,14,16,26H,5,12-13,15H2,1H3
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n/an/a 62n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
Inhibitory activity against Candida albicans Nmt (CaNmt) using substrate peptide GLTISKLFR-R-NH2 (0.5 uM) and myristoyl-CoA (0.5 uM)


Bioorg Med Chem Lett 13: 87-91 (2003)


BindingDB Entry DOI: 10.7270/Q25D8V2K
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50219311
PNG
(CHEMBL346363)
Show SMILES Cc1c(COc2ccccc2)oc2cccc(OCCCNCc3cccnc3)c12
Show InChI InChI=1S/C25H26N2O3/c1-19-24(18-29-21-9-3-2-4-10-21)30-23-12-5-11-22(25(19)23)28-15-7-14-27-17-20-8-6-13-26-16-20/h2-6,8-13,16,27H,7,14-15,17-18H2,1H3
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n/an/a 72n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
Inhibitory activity against Candida albicans N-Myristoyltransferase (CaNmt) assessed as inhibitory concentration using substrate peptide and myristot...


Bioorg Med Chem Lett 12: 607-10 (2002)


BindingDB Entry DOI: 10.7270/Q2PC34K1
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50219304
PNG
(CHEMBL433886)
Show SMILES Cc1c(COc2ccc(Cl)cc2)oc2cccc(OCCCNCc3cccnc3)c12
Show InChI InChI=1S/C25H25ClN2O3/c1-18-24(17-30-21-10-8-20(26)9-11-21)31-23-7-2-6-22(25(18)23)29-14-4-13-28-16-19-5-3-12-27-15-19/h2-3,5-12,15,28H,4,13-14,16-17H2,1H3
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n/an/a 73n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
Inhibitory activity against Candida albicans N-Myristoyltransferase (CaNmt) assessed as inhibitory concentration using substrate peptide and myristot...


Bioorg Med Chem Lett 12: 607-10 (2002)


BindingDB Entry DOI: 10.7270/Q2PC34K1
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50471300
PNG
(CHEMBL89727)
Show SMILES COC(=O)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)Cc1ccc(CCCCn2ccnc2C)cc1)C(O)=O
Show InChI InChI=1S/C29H42N6O8/c1-19-31-14-16-35(19)15-6-4-7-20-9-11-21(12-10-20)17-24(37)32-23(18-36)27(39)33-22(8-3-5-13-30)26(38)34-25(28(40)41)29(42)43-2/h9-12,14,16,22-23,25,36H,3-8,13,15,17-18,30H2,1-2H3,(H,32,37)(H,33,39)(H,34,38)(H,40,41)/t22-,23-,25+/m0/s1
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n/an/a 81n/an/an/an/an/an/a



G.D. Searle and Company

Curated by ChEMBL


Assay Description
Inhibition activity against N-myristoyltransferase (NMT) of candida albicans.


J Med Chem 40: 2609-25 (1997)


Article DOI: 10.1021/jm970094w
BindingDB Entry DOI: 10.7270/Q2BR8VXS
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50220560
PNG
(CHEMBL173962)
Show SMILES Cc1c(oc2cccc(OCCCNCc3cccnc3)c12)C(=O)c1nccs1
Show InChI InChI=1S/C22H21N3O3S/c1-15-19-17(27-11-4-9-24-14-16-5-3-8-23-13-16)6-2-7-18(19)28-21(15)20(26)22-25-10-12-29-22/h2-3,5-8,10,12-13,24H,4,9,11,14H2,1H3
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n/an/a 91n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Candida albicans Nmt (CaNmt) using substrate peptide GLTISKLFR-R-NH2 (0.5 uM) and myristoyl-CoA (0.5 uM)


Bioorg Med Chem Lett 13: 87-91 (2003)


BindingDB Entry DOI: 10.7270/Q25D8V2K
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50101969
PNG
(3-Methyl-4-{3-[(pyridin-3-ylmethyl)-amino]-propoxy...)
Show SMILES CCOC(=O)c1oc2cccc(OCCCNCc3cccnc3)c2c1C
Show InChI InChI=1S/C21H24N2O4/c1-3-25-21(24)20-15(2)19-17(8-4-9-18(19)27-20)26-12-6-11-23-14-16-7-5-10-22-13-16/h4-5,7-10,13,23H,3,6,11-12,14H2,1-2H3
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n/an/a 100n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
Inhibitory activity against Candida albicans N-Myristoyltransferase (CaNmt) assessed as inhibitory concentration using substrate peptide and myristot...


Bioorg Med Chem Lett 12: 607-10 (2002)


BindingDB Entry DOI: 10.7270/Q2PC34K1
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50101969
PNG
(3-Methyl-4-{3-[(pyridin-3-ylmethyl)-amino]-propoxy...)
Show SMILES CCOC(=O)c1oc2cccc(OCCCNCc3cccnc3)c2c1C
Show InChI InChI=1S/C21H24N2O4/c1-3-25-21(24)20-15(2)19-17(8-4-9-18(19)27-20)26-12-6-11-23-14-16-7-5-10-22-13-16/h4-5,7-10,13,23H,3,6,11-12,14H2,1-2H3
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n/an/a 100n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
Inhibitory activity against Candida albicans N-myristoyltransferase (CaNmt)


Bioorg Med Chem Lett 11: 1833-7 (2001)


BindingDB Entry DOI: 10.7270/Q2KS6TRW
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50034988
PNG
(11-Amino-undecanoic acid {(S)-1-[(S)-5-amino-1-(2-...)
Show SMILES NCCCCCCCCCCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)NCCC1CCCCC1
Show InChI InChI=1S/C28H55N5O4/c29-19-12-6-4-2-1-3-5-10-17-26(35)32-25(22-34)28(37)33-24(16-11-13-20-30)27(36)31-21-18-23-14-8-7-9-15-23/h23-25,34H,1-22,29-30H2,(H,31,36)(H,32,35)(H,33,37)/t24-,25-/m0/s1
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n/an/a 110n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Candida albicans N-myristoyltransferase (NMT) with peptide GNAASARR-NH2 and [3H]myristoyl-CoA at 1 uM


Citation and Details

BindingDB Entry DOI: 10.7270/Q2FJ2JXN
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50219306
PNG
(CHEMBL154079)
Show SMILES Cc1c(COc2cccc(F)c2)oc2cccc(OCCCNCc3cccnc3)c12
Show InChI InChI=1S/C25H25FN2O3/c1-18-24(17-30-21-8-2-7-20(26)14-21)31-23-10-3-9-22(25(18)23)29-13-5-12-28-16-19-6-4-11-27-15-19/h2-4,6-11,14-15,28H,5,12-13,16-17H2,1H3
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n/an/a 110n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
Inhibitory activity against Candida albicans N-Myristoyltransferase (CaNmt) assessed as inhibitory concentration using substrate peptide and myristot...


Bioorg Med Chem Lett 12: 607-10 (2002)


BindingDB Entry DOI: 10.7270/Q2PC34K1
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50034988
PNG
(11-Amino-undecanoic acid {(S)-1-[(S)-5-amino-1-(2-...)
Show SMILES NCCCCCCCCCCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)NCCC1CCCCC1
Show InChI InChI=1S/C28H55N5O4/c29-19-12-6-4-2-1-3-5-10-17-26(35)32-25(22-34)28(37)33-24(16-11-13-20-30)27(36)31-21-18-23-14-8-7-9-15-23/h23-25,34H,1-22,29-30H2,(H,31,36)(H,32,35)(H,33,37)/t24-,25-/m0/s1
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n/an/a 110n/an/an/an/an/an/a



G.D. Searle and Co.

Curated by ChEMBL


Assay Description
Inhibitory activity against Candida albicans N-Myristoyltransferase (NMT).


J Med Chem 38: 1837-40 (1995)


Article DOI: 10.1021/jm00011a001
BindingDB Entry DOI: 10.7270/Q23J3GPZ
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50059428
PNG
((S)-6-Amino-2-[(S)-3-hydroxy-2-(2-{4-[4-(2-methyl-...)
Show SMILES CCCC(C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)NCCC1CCCCC1)c1ccc(CCCCn2ccnc2C)cc1
Show InChI InChI=1S/C36H58N6O4/c1-3-11-31(30-18-16-29(17-19-30)14-8-10-24-42-25-23-38-27(42)2)34(44)41-33(26-43)36(46)40-32(15-7-9-21-37)35(45)39-22-20-28-12-5-4-6-13-28/h16-19,23,25,28,31-33,43H,3-15,20-22,24,26,37H2,1-2H3,(H,39,45)(H,40,46)(H,41,44)/t31?,32-,33-/m0/s1
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n/an/a 130n/an/an/an/an/an/a



G.D. Searle and Company

Curated by ChEMBL


Assay Description
Inhibition activity against N-myristoyltransferase (NMT) of candida albicans.


J Med Chem 40: 2609-25 (1997)


Article DOI: 10.1021/jm970094w
BindingDB Entry DOI: 10.7270/Q2BR8VXS
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50471303
PNG
(CHEMBL88093)
Show SMILES CCc1nccn1CCCCc1ccc(CC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)NCCC2CCCCC2)cc1
Show InChI InChI=1S/C34H54N6O4/c1-2-31-36-21-23-40(31)22-9-7-12-27-14-16-28(17-15-27)24-32(42)38-30(25-41)34(44)39-29(13-6-8-19-35)33(43)37-20-18-26-10-4-3-5-11-26/h14-17,21,23,26,29-30,41H,2-13,18-20,22,24-25,35H2,1H3,(H,37,43)(H,38,42)(H,39,44)/t29-,30-/m0/s1
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n/an/a 147n/an/an/an/an/an/a



G.D. Searle and Company

Curated by ChEMBL


Assay Description
Inhibition activity against N-myristoyltransferase (NMT) of candida albicans.


J Med Chem 40: 2609-25 (1997)


Article DOI: 10.1021/jm970094w
BindingDB Entry DOI: 10.7270/Q2BR8VXS
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50471308
PNG
(CHEMBL89452)
Show SMILES CC(C)c1nccn1CCCCc1ccc(CC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)NCCC2CCCCC2)cc1
Show InChI InChI=1S/C35H56N6O4/c1-26(2)33-37-21-23-41(33)22-9-7-12-28-14-16-29(17-15-28)24-32(43)39-31(25-42)35(45)40-30(13-6-8-19-36)34(44)38-20-18-27-10-4-3-5-11-27/h14-17,21,23,26-27,30-31,42H,3-13,18-20,22,24-25,36H2,1-2H3,(H,38,44)(H,39,43)(H,40,45)/t30-,31-/m0/s1
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n/an/a 200n/an/an/an/an/an/a



G.D. Searle and Company

Curated by ChEMBL


Assay Description
Inhibition activity against N-myristoyltransferase (NMT) of candida albicans.


J Med Chem 40: 2609-25 (1997)


Article DOI: 10.1021/jm970094w
BindingDB Entry DOI: 10.7270/Q2BR8VXS
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50034991
PNG
(11-Amino-undecanoic acid {(S)-1-[(S)-5-amino-1-((S...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)CCCCCCCCCCN)C(N)=O
Show InChI InChI=1S/C26H52N6O5/c1-19(2)17-21(24(29)35)32-25(36)20(13-10-12-16-28)31-26(37)22(18-33)30-23(34)14-9-7-5-3-4-6-8-11-15-27/h19-22,33H,3-18,27-28H2,1-2H3,(H2,29,35)(H,30,34)(H,31,37)(H,32,36)/t20-,21-,22-/m0/s1
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n/an/a 230n/an/an/an/an/an/a



G.D. Searle and Co.

Curated by ChEMBL


Assay Description
Inhibitory activity against human N-Myristoyltransferase (NMT).


J Med Chem 38: 1837-40 (1995)


Article DOI: 10.1021/jm00011a001
BindingDB Entry DOI: 10.7270/Q23J3GPZ
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50214836
PNG
(CHEMBL279641)
Show SMILES Cc1nccn1CCCCc1ccc(CC(=O)N[C@@H](CO)C(=O)N[C@@H](CNC(=O)CN)C(=O)NCCC2CCCCC2)cc1
Show InChI InChI=1S/C32H49N7O5/c1-23-34-16-18-39(23)17-6-5-9-25-10-12-26(13-11-25)19-29(41)37-28(22-40)32(44)38-27(21-36-30(42)20-33)31(43)35-15-14-24-7-3-2-4-8-24/h10-13,16,18,24,27-28,40H,2-9,14-15,17,19-22,33H2,1H3,(H,35,43)(H,36,42)(H,37,41)(H,38,44)/t27-,28-/m0/s1
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n/an/a 260n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Candida albicans N-myristoyltransferase (NMT) with peptide GNAASARR-NH2 and [3H]myristoyl-CoA at 1 uM


Citation and Details

BindingDB Entry DOI: 10.7270/Q2FJ2JXN
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50470170
PNG
(CHEMBL54883)
Show SMILES NCCCCCCCCCCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)NCCC1CCCCCCC1
Show InChI InChI=1S/C30H59N5O4/c31-21-14-9-4-2-1-3-8-12-19-28(37)34-27(24-36)30(39)35-26(18-13-15-22-32)29(38)33-23-20-25-16-10-6-5-7-11-17-25/h25-27,36H,1-24,31-32H2,(H,33,38)(H,34,37)(H,35,39)/t26-,27-/m0/s1
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n/an/a 300n/an/an/an/an/an/a



G.D. Searle and Co.

Curated by ChEMBL


Assay Description
Inhibitory activity against Candida albicans N-Myristoyltransferase (NMT).


J Med Chem 38: 1837-40 (1995)


Article DOI: 10.1021/jm00011a001
BindingDB Entry DOI: 10.7270/Q23J3GPZ
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50059434
PNG
((S)-6-Amino-2-[(S)-3-hydroxy-2-((S)-2-{4-[4-(2-met...)
Show SMILES C[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)NCCC1CCCCC1)c1ccc(CCCCn2ccnc2C)cc1
Show InChI InChI=1S/C34H54N6O4/c1-25(29-16-14-28(15-17-29)12-7-9-22-40-23-21-36-26(40)2)32(42)39-31(24-41)34(44)38-30(13-6-8-19-35)33(43)37-20-18-27-10-4-3-5-11-27/h14-17,21,23,25,27,30-31,41H,3-13,18-20,22,24,35H2,1-2H3,(H,37,43)(H,38,44)(H,39,42)/t25-,30-,31-/m0/s1
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n/an/a 310n/an/an/an/an/an/a



G.D. Searle and Company

Curated by ChEMBL


Assay Description
Inhibition activity against N-myristoyltransferase (NMT) of candida albicans.


J Med Chem 40: 2609-25 (1997)


Article DOI: 10.1021/jm970094w
BindingDB Entry DOI: 10.7270/Q2BR8VXS
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50470169
PNG
(CHEMBL294596)
Show SMILES NCCCC[C@H](NC(=O)[C@H](CO)NC(=O)Cc1ccc(CCCCn2ccnc2)cc1)C(=O)NCCC1CCCCC1
Show InChI InChI=1S/C32H50N6O4/c33-17-6-4-11-28(31(41)35-18-16-25-8-2-1-3-9-25)37-32(42)29(23-39)36-30(40)22-27-14-12-26(13-15-27)10-5-7-20-38-21-19-34-24-38/h12-15,19,21,24-25,28-29,39H,1-11,16-18,20,22-23,33H2,(H,35,41)(H,36,40)(H,37,42)/t28-,29-/m0/s1
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n/an/a 310n/an/an/an/an/an/a



G.D. Searle and Company

Curated by ChEMBL


Assay Description
Inhibition activity against N-myristoyltransferase (NMT) of candida albicans.


J Med Chem 40: 2609-25 (1997)


Article DOI: 10.1021/jm970094w
BindingDB Entry DOI: 10.7270/Q2BR8VXS
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50214841
PNG
(CHEMBL341147)
Show SMILES Cc1nccn1CCCCc1ccc(CC(=O)N[C@@H](CO)C(=O)N[C@@H](CSCCN)C(=O)NCCC2CCCCC2)cc1
Show InChI InChI=1S/C32H50N6O4S/c1-24-34-17-19-38(24)18-6-5-9-26-10-12-27(13-11-26)21-30(40)36-28(22-39)32(42)37-29(23-43-20-15-33)31(41)35-16-14-25-7-3-2-4-8-25/h10-13,17,19,25,28-29,39H,2-9,14-16,18,20-23,33H2,1H3,(H,35,41)(H,36,40)(H,37,42)/t28-,29-/m0/s1
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n/an/a 340n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Candida albicans N-myristoyltransferase (NMT) with peptide GNAASARR-NH2 and [3H]myristoyl-CoA at 1 uM


Citation and Details

BindingDB Entry DOI: 10.7270/Q2FJ2JXN
More data for this
Ligand-Target Pair
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