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14 molecules are shown

Wt: 596.8
BDBM50034993
Wt: 545.7
BDBM50057678
Wt: 593.7
BDBM50057680
Wt: 559.7
BDBM50057682
Wt: 559.7
BDBM50057684
Wt: 519.7
BDBM50057686
Wt: 587.8
BDBM50057689
Wt: 545.7
BDBM50057693
Wt: 851.0
BDBM50057701
Wt: 573.8
BDBM50057702
Wt: 589.7
BDBM50057703
Wt: 562.7
BDBM50057706
Wt: 602.8
BDBM50063542
Wt: 851.0
BDBM50291976

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 20 hits for monomerid = 50034993,50057678,50057680,50057682,50057684,50057686,50057689,50057693,50057701,50057702,50057703,50057706,50063542,50291976   
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
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Candida albicans (Yeast))
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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31n/an/an/an/an/an/an/an/a



G. D. Searle and Company

Curated by ChEMBL


Assay Description
The Compound was tested for the inhibition potency against C. albicans N-myristoyltransferase (NMT) and reported as apparent Ki


J Med Chem 41: 996-1000 (1998)


Article DOI: 10.1021/jm980001q
BindingDB Entry DOI: 10.7270/Q27080KF
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Candida albicans (Yeast))
BDBM50291976
PNG
(6-Amino-2-(2-{2-[2-[2-(2-amino-propionylamino)-4-m...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(N)=O
Show InChI InChI=1S/C39H66N10O11/c1-20(2)15-27(45-33(54)22(5)41)37(58)47-29(17-24-10-12-25(52)13-11-24)36(57)43-23(6)34(55)49-31(19-51)39(60)44-26(9-7-8-14-40)35(56)46-28(16-21(3)4)38(59)48-30(18-50)32(42)53/h10-13,20-23,26-31,50-52H,7-9,14-19,40-41H2,1-6H3,(H2,42,53)(H,43,57)(H,44,60)(H,45,54)(H,46,56)(H,47,58)(H,48,59)(H,49,55)/t22-,23-,26-,27-,28-,29-,30-,31-/m0/s1
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1.53E+4n/an/an/an/an/an/an/an/a



G. D. Searle and Company

Curated by ChEMBL


Assay Description
The Compound was tested for the inhibition potency against C. albicans N-myristoyltransferase (NMT) and reported as apparent Ki


J Med Chem 41: 996-1000 (1998)


Article DOI: 10.1021/jm980001q
BindingDB Entry DOI: 10.7270/Q27080KF
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Candida albicans (Yeast))
BDBM50057680
PNG
((S)-6-Amino-2-[(S)-2-(2-{4-[2-(4-aminomethyl-pheny...)
Show SMILES NCCCC[C@H](NC(=O)[C@H](CO)NC(=O)Cc1ccc(CCc2ccc(CN)cc2)cc1)C(=O)NCCC1CCCCC1
Show InChI InChI=1S/C34H51N5O4/c35-20-5-4-8-30(33(42)37-21-19-25-6-2-1-3-7-25)39-34(43)31(24-40)38-32(41)22-28-15-11-26(12-16-28)9-10-27-13-17-29(23-36)18-14-27/h11-18,25,30-31,40H,1-10,19-24,35-36H2,(H,37,42)(H,38,41)(H,39,43)/t30-,31-/m0/s1
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n/an/a 750n/an/an/an/an/an/a



G. D. Searle Research and Development

Curated by ChEMBL


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


J Med Chem 40: 1422-38 (1997)


Article DOI: 10.1021/jm9608671
BindingDB Entry DOI: 10.7270/Q2GB24Q7
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Candida albicans (Yeast))
BDBM50057678
PNG
((S)-6-Amino-2-((S)-2-{2-[3-(5-amino-pentyl)-phenyl...)
Show SMILES NCCCCCc1cccc(CC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)NCCC2CCCCC2)c1
Show InChI InChI=1S/C30H51N5O4/c31-17-7-2-5-12-24-13-9-14-25(20-24)21-28(37)34-27(22-36)30(39)35-26(15-6-8-18-32)29(38)33-19-16-23-10-3-1-4-11-23/h9,13-14,20,23,26-27,36H,1-8,10-12,15-19,21-22,31-32H2,(H,33,38)(H,34,37)(H,35,39)/t26-,27-/m0/s1
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n/an/a 520n/an/an/an/an/an/a



G. D. Searle Research and Development

Curated by ChEMBL


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


J Med Chem 40: 1422-38 (1997)


Article DOI: 10.1021/jm9608671
BindingDB Entry DOI: 10.7270/Q2GB24Q7
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Candida albicans (Yeast))
BDBM50057682
PNG
(7-(4-Aminomethyl-phenyl)-heptanoic acid {(S)-1-[(S...)
Show SMILES NCCCC[C@H](NC(=O)[C@H](CO)NC(=O)CCCCCCc1ccc(CN)cc1)C(=O)NCCC1CCCCC1
Show InChI InChI=1S/C31H53N5O4/c32-20-9-8-13-27(30(39)34-21-19-24-10-5-3-6-11-24)36-31(40)28(23-37)35-29(38)14-7-2-1-4-12-25-15-17-26(22-33)18-16-25/h15-18,24,27-28,37H,1-14,19-23,32-33H2,(H,34,39)(H,35,38)(H,36,40)/t27-,28-/m0/s1
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n/an/a 340n/an/an/an/an/an/a



G. D. Searle Research and Development

Curated by ChEMBL


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


J Med Chem 40: 1422-38 (1997)


Article DOI: 10.1021/jm9608671
BindingDB Entry DOI: 10.7270/Q2GB24Q7
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Candida albicans (Yeast))
BDBM50057686
PNG
(11-Amino-undecanoic acid [(S)-1-((S)-5-amino-1-phe...)
Show SMILES NCCCCCCCCCCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)NCCc1ccccc1
Show InChI InChI=1S/C28H49N5O4/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/h7-9,14-15,24-25,34H,1-6,10-13,16-22,29-30H2,(H,31,36)(H,32,35)(H,33,37)/t24-,25-/m0/s1
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n/an/a 5.00E+3n/an/an/an/an/an/a



G. D. Searle Research and Development

Curated by ChEMBL


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


J Med Chem 40: 1422-38 (1997)


Article DOI: 10.1021/jm9608671
BindingDB Entry DOI: 10.7270/Q2GB24Q7
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Candida albicans (Yeast))
BDBM50057693
PNG
((S)-6-Amino-2-((S)-2-{2-[4-(5-amino-pentyl)-phenyl...)
Show SMILES NCCCCCc1ccc(CC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)NCCC2CCCCC2)cc1
Show InChI InChI=1S/C30H51N5O4/c31-18-7-2-5-11-24-13-15-25(16-14-24)21-28(37)34-27(22-36)30(39)35-26(12-6-8-19-32)29(38)33-20-17-23-9-3-1-4-10-23/h13-16,23,26-27,36H,1-12,17-22,31-32H2,(H,33,38)(H,34,37)(H,35,39)/t26-,27-/m0/s1
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n/an/a 190n/an/an/an/an/an/a



G. D. Searle Research and Development

Curated by ChEMBL


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


J Med Chem 40: 1422-38 (1997)


Article DOI: 10.1021/jm9608671
BindingDB Entry DOI: 10.7270/Q2GB24Q7
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Candida albicans (Yeast))
BDBM50057689
PNG
((S)-6-Amino-2-((S)-2-{2-[4-(8-amino-octyl)-phenyl]...)
Show SMILES NCCCCCCCCc1ccc(CC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)NCCC2CCCCC2)cc1
Show InChI InChI=1S/C33H57N5O4/c34-21-10-4-2-1-3-6-14-27-16-18-28(19-17-27)24-31(40)37-30(25-39)33(42)38-29(15-9-11-22-35)32(41)36-23-20-26-12-7-5-8-13-26/h16-19,26,29-30,39H,1-15,20-25,34-35H2,(H,36,41)(H,37,40)(H,38,42)/t29-,30-/m0/s1
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n/an/a 750n/an/an/an/an/an/a



G. D. Searle Research and Development

Curated by ChEMBL


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


J Med Chem 40: 1422-38 (1997)


Article DOI: 10.1021/jm9608671
BindingDB Entry DOI: 10.7270/Q2GB24Q7
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Candida albicans (Yeast))
BDBM50057701
PNG
(6-Amino-2-(2-{2-[2-[2-(3-amino-propionylamino)-4-m...)
Show SMILES CC(C)C[C@H](NC(=O)CCN)C(=O)N[C@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@H](CO)C(=O)N[C@H](CCCCN)C(=O)N[C@H](CC(C)C)C(=O)N[C@H](CO)C(N)=O
Show InChI InChI=1S/C39H66N10O11/c1-21(2)16-27(44-32(53)13-15-41)37(58)47-29(18-24-9-11-25(52)12-10-24)36(57)43-23(5)34(55)49-31(20-51)39(60)45-26(8-6-7-14-40)35(56)46-28(17-22(3)4)38(59)48-30(19-50)33(42)54/h9-12,21-23,26-31,50-52H,6-8,13-20,40-41H2,1-5H3,(H2,42,54)(H,43,57)(H,44,53)(H,45,60)(H,46,56)(H,47,58)(H,48,59)(H,49,55)/t23-,26+,27-,28+,29+,30+,31+/m0/s1
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n/an/a 1.10E+5n/an/an/an/an/an/a



G. D. Searle Research and Development

Curated by ChEMBL


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


J Med Chem 40: 1422-38 (1997)


Article DOI: 10.1021/jm9608671
BindingDB Entry DOI: 10.7270/Q2GB24Q7
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Candida albicans (Yeast))
BDBM50057703
PNG
((S)-6-Amino-2-((S)-2-{2-[4-(4-aminomethyl-phenylet...)
Show SMILES NCCCC[C@H](NC(=O)[C@H](CO)NC(=O)Cc1ccc(cc1)C#Cc1ccc(CN)cc1)C(=O)NCCC1CCCCC1
Show InChI InChI=1S/C34H47N5O4/c35-20-5-4-8-30(33(42)37-21-19-25-6-2-1-3-7-25)39-34(43)31(24-40)38-32(41)22-28-15-11-26(12-16-28)9-10-27-13-17-29(23-36)18-14-27/h11-18,25,30-31,40H,1-8,19-24,35-36H2,(H,37,42)(H,38,41)(H,39,43)/t30-,31-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



G. D. Searle Research and Development

Curated by ChEMBL


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


J Med Chem 40: 1422-38 (1997)


Article DOI: 10.1021/jm9608671
BindingDB Entry DOI: 10.7270/Q2GB24Q7
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Candida albicans (Yeast))
BDBM50057706
PNG
(11-Amino-undecanoic acid {(S)-1-[(S)-5-amino-1-((S...)
Show SMILES NCCCCCCCCCCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C29H50N6O5/c30-18-12-6-4-2-1-3-5-10-17-26(37)33-25(21-36)29(40)34-23(16-11-13-19-31)28(39)35-24(27(32)38)20-22-14-8-7-9-15-22/h7-9,14-15,23-25,36H,1-6,10-13,16-21,30-31H2,(H2,32,38)(H,33,37)(H,34,40)(H,35,39)/t23-,24-,25-/m0/s1
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n/an/a 8.20E+3n/an/an/an/an/an/a



G. D. Searle Research and Development

Curated by ChEMBL


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


J Med Chem 40: 1422-38 (1997)


Article DOI: 10.1021/jm9608671
BindingDB Entry DOI: 10.7270/Q2GB24Q7
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Candida albicans (Yeast))
BDBM50057684
PNG
((S)-6-Amino-2-((S)-2-{2-[4-(6-amino-hexyl)-phenyl]...)
Show SMILES NCCCCCCc1ccc(CC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)NCCC2CCCCC2)cc1
Show InChI InChI=1S/C31H53N5O4/c32-19-8-2-1-4-12-25-14-16-26(17-15-25)22-29(38)35-28(23-37)31(40)36-27(13-7-9-20-33)30(39)34-21-18-24-10-5-3-6-11-24/h14-17,24,27-28,37H,1-13,18-23,32-33H2,(H,34,39)(H,35,38)(H,36,40)/t27-,28-/m0/s1
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n/an/a 110n/an/an/an/an/an/a



G. D. Searle Research and Development

Curated by ChEMBL


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


J Med Chem 40: 1422-38 (1997)


Article DOI: 10.1021/jm9608671
BindingDB Entry DOI: 10.7270/Q2GB24Q7
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Candida albicans (Yeast))
BDBM50057702
PNG
((S)-6-Amino-2-((S)-2-{2-[4-(6-amino-hexyl)-phenyl]...)
Show SMILES CC(C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)NCCC1CCCCC1)c1ccc(CCCCCCN)cc1
Show InChI InChI=1S/C32H55N5O4/c1-24(27-17-15-26(16-18-27)13-5-2-3-9-20-33)30(39)37-29(23-38)32(41)36-28(14-8-10-21-34)31(40)35-22-19-25-11-6-4-7-12-25/h15-18,24-25,28-29,38H,2-14,19-23,33-34H2,1H3,(H,35,40)(H,36,41)(H,37,39)/t24?,28-,29-/m0/s1
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n/an/a 43n/an/an/an/an/an/a



G. D. Searle Research and Development

Curated by ChEMBL


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


J Med Chem 40: 1422-38 (1997)


Article DOI: 10.1021/jm9608671
BindingDB Entry DOI: 10.7270/Q2GB24Q7
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Peptide N-myristoyltransferase


(Homo sapiens-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 830n/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)


Article DOI: 10.1016/s0960-894x(01)00319-5
More data for this
Ligand-Target Pair
Peptide N-myristoyltransferase


(Homo sapiens-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>1.40E+5n/an/an/an/an/an/a



Nippon Roche Research Center

Curated by ChEMBL


Assay Description
Inhibitory activity against human N-myristoyltransferase (HsNmt)


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


Article DOI: 10.1016/s0960-894x(01)00319-5
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase


(Saccharomyces cerevisiae)
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 24n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of Saccharomyces cerevisiae NMT


J Biol Chem 282: 22185-94 (2007)


Article DOI: 10.1074/jbc.M702696200
BindingDB Entry DOI: 10.7270/Q24Q7VWR
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Peptide N-myristoyltransferase


(Homo sapiens-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 1.41E+4n/an/an/an/an/an/a


TBA

Assay Description
Tested for Inhibitory concentration against human N-myristoyltransferase (NMT) in radiochemical HPLC end point assay with peptide GNAASARR-NH2 and [3...


Citation and Details
More data for this
Ligand-Target Pair
Peptide N-myristoyltransferase


(Homo sapiens-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
More data for this
Ligand-Target Pair
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Candida albicans (Yeast))
BDBM50063542
PNG
(CHEMBL6227 | N-{(S)-2-[3-(4-Amino-butyl)-4-(2-cycl...)
Show SMILES Cc1nccn1CCCCc1ccc(CC(=O)N[C@H](CO)Cc2ccc(OCCC3CCCCC3)c(CCCCN)c2)cc1
Show InChI InChI=1S/C37H54N4O3/c1-29-39-21-23-41(29)22-8-6-11-31-13-15-32(16-14-31)27-37(43)40-35(28-42)26-33-17-18-36(34(25-33)12-5-7-20-38)44-24-19-30-9-3-2-4-10-30/h13-18,21,23,25,30,35,42H,2-12,19-20,22,24,26-28,38H2,1H3,(H,40,43)/t35-/m0/s1
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n/an/a 2.00E+4n/an/an/an/an/an/a



G. D. Searle and Company

Curated by ChEMBL


Assay Description
compound was tested for the inhibition potency against C. albicans N-myristoyltransferase (NMT) using peptide substrate GNAASARR-NH2 at its apparent ...


J Med Chem 41: 996-1000 (1998)


Article DOI: 10.1021/jm980001q
BindingDB Entry DOI: 10.7270/Q27080KF
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(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 60n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Compound was tested for its inhibitory activity against Candida albicans N-Myristoyltransferase (NMT)


Bioorg Med Chem Lett 6: 1977-1982 (1996)


Article DOI: 10.1016/0960-894X(96)00354-X
BindingDB Entry DOI: 10.7270/Q2TH8MPP
More data for this
Ligand-Target Pair