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Compile Data Set for Download or QSAR

Found 1006 hits Enz. Inhib. hit(s) with Target = 'N-myristoyltransferase (NMT1)'   
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
Peptide N-myristoyltransferase


(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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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)


Article DOI: 10.1039/c5md00241a
BindingDB Entry DOI: 10.7270/Q2TB18R2
More data for this
Ligand-Target Pair
Peptide N-myristoyltransferase


(Homo sapiens (Human))
BDBM50135488
PNG
(CHEMBL3754571)
Show SMILES C(c1noc(n1)-c1cccnc1OC1CCNCC1)c1cccc2ncccc12
Show InChI InChI=1S/C22H21N5O2/c1-4-15(17-5-2-10-24-19(17)7-1)14-20-26-22(29-27-20)18-6-3-11-25-21(18)28-16-8-12-23-13-9-16/h1-7,10-11,16,23H,8-9,12-14H2
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24n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human NMT1 by 7-diethylamine-3-(4'maleimidylphenyl)-4-methylcoumarin based fluorescence assay


Medchemcomm 6: 1767-1772 (2016)


Article DOI: 10.1039/c5md00242g
BindingDB Entry DOI: 10.7270/Q27M09RK
More data for this
Ligand-Target Pair
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Homo sapiens (Human))
BDBM50027680
PNG
(CHEMBL3357975)
Show SMILES N[C@@H](CC(=O)N1C[C@H](CO)[C@H](C1)c1ccc(Cl)c(NC(=O)Cc2ccc(F)cc2)c1)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C29H30Cl2FN3O3/c30-22-6-1-18(2-7-22)11-24(33)14-29(38)35-15-21(17-36)25(16-35)20-5-10-26(31)27(13-20)34-28(37)12-19-3-8-23(32)9-4-19/h1-10,13,21,24-25,36H,11-12,14-17,33H2,(H,34,37)/t21-,24-,25-/m1/s1
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27n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human NMT1 using GSNKSKPKDASQRRR-NH2 as substrate by CPM fluorescence assay


J Med Chem 57: 8664-70 (2014)


Article DOI: 10.1021/jm5011397
BindingDB Entry DOI: 10.7270/Q2X63PJN
More data for this
Ligand-Target Pair
Peptide N-myristoyltransferase


(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)


Article DOI: 10.1039/c5md00241a
BindingDB Entry DOI: 10.7270/Q2TB18R2
More data for this
Ligand-Target Pair
Peptide N-myristoyltransferase


(Homo sapiens (Human))
BDBM50135490
PNG
(CHEMBL3753789)
Show SMILES CC(C)N1CCC(CC1)Oc1ncccc1-c1nc(Cc2c(C)nn(C)c2C)no1
Show InChI InChI=1S/C22H30N6O2/c1-14(2)28-11-8-17(9-12-28)29-21-18(7-6-10-23-21)22-24-20(26-30-22)13-19-15(3)25-27(5)16(19)4/h6-7,10,14,17H,8-9,11-13H2,1-5H3
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180n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human NMT1 by 7-diethylamine-3-(4'maleimidylphenyl)-4-methylcoumarin based fluorescence assay


Medchemcomm 6: 1767-1772 (2016)


Article DOI: 10.1039/c5md00242g
BindingDB Entry DOI: 10.7270/Q27M09RK
More data for this
Ligand-Target Pair
Peptide N-myristoyltransferase


(Homo sapiens (Human))
BDBM50135530
PNG
(CHEMBL3752766)
Show SMILES Cc1nn(C)c(C)c1Cc1noc(n1)-c1cccnc1OC1CCNCC1
Show InChI InChI=1S/C19H24N6O2/c1-12-16(13(2)25(3)23-12)11-17-22-19(27-24-17)15-5-4-8-21-18(15)26-14-6-9-20-10-7-14/h4-5,8,14,20H,6-7,9-11H2,1-3H3
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200n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human NMT1 by 7-diethylamine-3-(4'maleimidylphenyl)-4-methylcoumarin based fluorescence assay


Medchemcomm 6: 1767-1772 (2016)


Article DOI: 10.1039/c5md00242g
BindingDB Entry DOI: 10.7270/Q27M09RK
More data for this
Ligand-Target Pair
Peptide N-myristoyltransferase


(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)


Article DOI: 10.1039/c5md00241a
BindingDB Entry DOI: 10.7270/Q2TB18R2
More data for this
Ligand-Target Pair
Peptide N-myristoyltransferase


(Homo sapiens (Human))
BDBM50135492
PNG
(CHEMBL3754763)
Show SMILES CCN1CCC(CC1)Oc1ncccc1-c1nc(Cc2c(C)nn(C)c2C)no1
Show InChI InChI=1S/C21H28N6O2/c1-5-27-11-8-16(9-12-27)28-20-17(7-6-10-22-20)21-23-19(25-29-21)13-18-14(2)24-26(4)15(18)3/h6-7,10,16H,5,8-9,11-13H2,1-4H3
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270n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human NMT1 by 7-diethylamine-3-(4'maleimidylphenyl)-4-methylcoumarin based fluorescence assay


Medchemcomm 6: 1767-1772 (2016)


Article DOI: 10.1039/c5md00242g
BindingDB Entry DOI: 10.7270/Q27M09RK
More data for this
Ligand-Target Pair
Peptide N-myristoyltransferase


(Homo sapiens (Human))
BDBM50135487
PNG
(CHEMBL3753421)
Show SMILES COc1cccc(Cc2noc(n2)-c2cccnc2OC2CCNCC2)c1
Show InChI InChI=1S/C20H22N4O3/c1-25-16-5-2-4-14(12-16)13-18-23-20(27-24-18)17-6-3-9-22-19(17)26-15-7-10-21-11-8-15/h2-6,9,12,15,21H,7-8,10-11,13H2,1H3
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270n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human NMT1 by 7-diethylamine-3-(4'maleimidylphenyl)-4-methylcoumarin based fluorescence assay


Medchemcomm 6: 1767-1772 (2016)


Article DOI: 10.1039/c5md00242g
BindingDB Entry DOI: 10.7270/Q27M09RK
More data for this
Ligand-Target Pair
Peptide N-myristoyltransferase


(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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360n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human NMT1 by 7-diethylamine-3-(4'maleimidylphenyl)-4-methylcoumarin based fluorescence assay


Medchemcomm 6: 1767-1772 (2016)


Article DOI: 10.1039/c5md00242g
BindingDB Entry DOI: 10.7270/Q27M09RK
More data for this
Ligand-Target Pair
Peptide N-myristoyltransferase


(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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430n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human NMT1 by 7-diethylamine-3-(4'maleimidylphenyl)-4-methylcoumarin based fluorescence assay


Medchemcomm 6: 1767-1772 (2016)


Article DOI: 10.1039/c5md00242g
BindingDB Entry DOI: 10.7270/Q27M09RK
More data for this
Ligand-Target Pair
Peptide N-myristoyltransferase


(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)


Article DOI: 10.1039/c5md00241a
BindingDB Entry DOI: 10.7270/Q2TB18R2
More data for this
Ligand-Target Pair
Peptide N-myristoyltransferase


(Homo sapiens (Human))
BDBM50135529
PNG
(CHEMBL3754678)
Show SMILES CN1CCC(CC1)Oc1ncccc1-c1nc(Cc2c(C)nn(C)c2C)no1
Show InChI InChI=1S/C20H26N6O2/c1-13-17(14(2)26(4)23-13)12-18-22-20(28-24-18)16-6-5-9-21-19(16)27-15-7-10-25(3)11-8-15/h5-6,9,15H,7-8,10-12H2,1-4H3
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510n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human NMT1 by 7-diethylamine-3-(4'maleimidylphenyl)-4-methylcoumarin based fluorescence assay


Medchemcomm 6: 1767-1772 (2016)


Article DOI: 10.1039/c5md00242g
BindingDB Entry DOI: 10.7270/Q27M09RK
More data for this
Ligand-Target Pair
Peptide N-myristoyltransferase


(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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540n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human NMT1 by 7-diethylamine-3-(4'maleimidylphenyl)-4-methylcoumarin based fluorescence assay


Medchemcomm 6: 1767-1772 (2016)


Article DOI: 10.1039/c5md00242g
BindingDB Entry DOI: 10.7270/Q27M09RK
More data for this
Ligand-Target Pair
Peptide N-myristoyltransferase


(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)


Article DOI: 10.1039/c5md00241a
BindingDB Entry DOI: 10.7270/Q2TB18R2
More data for this
Ligand-Target Pair
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Homo sapiens (Human))
BDBM50027677
PNG
(CHEMBL3344387)
Show SMILES N[C@@H](CC(=O)N1C[C@H](CO)[C@H](C1)c1ccc(Cl)cc1)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C21H24Cl2N2O2/c22-17-5-1-14(2-6-17)9-19(24)10-21(27)25-11-16(13-26)20(12-25)15-3-7-18(23)8-4-15/h1-8,16,19-20,26H,9-13,24H2/t16-,19-,20-/m1/s1
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631n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human NMT1 using GSNKSKPKDASQRRR-NH2 as substrate by CPM fluorescence assay


J Med Chem 57: 8664-70 (2014)


Article DOI: 10.1021/jm5011397
BindingDB Entry DOI: 10.7270/Q2X63PJN
More data for this
Ligand-Target Pair
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Homo sapiens (Human))
BDBM50134769
PNG
(CHEMBL3754615)
Show SMILES Clc1ccc(OC2CCNCC2)c(c1)-c1nc(Cc2ccccc2)no1
Show InChI InChI=1S/C20H20ClN3O2/c21-15-6-7-18(25-16-8-10-22-11-9-16)17(13-15)20-23-19(24-26-20)12-14-4-2-1-3-5-14/h1-7,13,16,22H,8-12H2
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730n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human NMT1 by 7-diethylamine-3-(4'maleimidylphenyl)-4-methylcoumarin based fluorescence assay


Medchemcomm 6: 1767-1772 (2016)


Article DOI: 10.1039/c5md00242g
BindingDB Entry DOI: 10.7270/Q27M09RK
More data for this
Ligand-Target Pair
Peptide N-myristoyltransferase


(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)


Article DOI: 10.1039/c5md00241a
BindingDB Entry DOI: 10.7270/Q2TB18R2
More data for this
Ligand-Target Pair
Peptide N-myristoyltransferase


(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)


Article DOI: 10.1039/c5md00241a
BindingDB Entry DOI: 10.7270/Q2TB18R2
More data for this
Ligand-Target Pair
Peptide N-myristoyltransferase


(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)


Article DOI: 10.1039/c5md00241a
BindingDB Entry DOI: 10.7270/Q2TB18R2
More data for this
Ligand-Target Pair
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Homo sapiens (Human))
BDBM50134768
PNG
(CHEMBL3753269)
Show SMILES Fc1ccc(OC2CCNCC2)c(c1)-c1nc(Cc2ccccc2)no1
Show InChI InChI=1S/C20H20FN3O2/c21-15-6-7-18(25-16-8-10-22-11-9-16)17(13-15)20-23-19(24-26-20)12-14-4-2-1-3-5-14/h1-7,13,16,22H,8-12H2
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1.00E+3n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human NMT1 by 7-diethylamine-3-(4'maleimidylphenyl)-4-methylcoumarin based fluorescence assay


Medchemcomm 6: 1767-1772 (2016)


Article DOI: 10.1039/c5md00242g
BindingDB Entry DOI: 10.7270/Q27M09RK
More data for this
Ligand-Target Pair
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Homo sapiens (Human))
BDBM50134764
PNG
(CHEMBL3754427)
Show SMILES COc1ccc(-c2nc(Cc3ccccc3)no2)c(OC2CCNCC2)c1
Show InChI InChI=1S/C21H23N3O3/c1-25-17-7-8-18(19(14-17)26-16-9-11-22-12-10-16)21-23-20(24-27-21)13-15-5-3-2-4-6-15/h2-8,14,16,22H,9-13H2,1H3
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1.20E+3n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human NMT1 by 7-diethylamine-3-(4'maleimidylphenyl)-4-methylcoumarin based fluorescence assay


Medchemcomm 6: 1767-1772 (2016)


Article DOI: 10.1039/c5md00242g
BindingDB Entry DOI: 10.7270/Q27M09RK
More data for this
Ligand-Target Pair
Peptide N-myristoyltransferase


(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)


Article DOI: 10.1039/c5md00241a
BindingDB Entry DOI: 10.7270/Q2TB18R2
More data for this
Ligand-Target Pair
Peptide N-myristoyltransferase


(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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1.40E+3n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human NMT1 by 7-diethylamine-3-(4'maleimidylphenyl)-4-methylcoumarin based fluorescence assay


Medchemcomm 6: 1767-1772 (2016)


Article DOI: 10.1039/c5md00242g
BindingDB Entry DOI: 10.7270/Q27M09RK
More data for this
Ligand-Target Pair
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Homo sapiens (Human))
BDBM50384914
PNG
(CHEMBL2036496 | CHEMBL2079453)
Show SMILES CCCCc1c(C)nc2ccc(OC)cc2c1SCCC#N
Show InChI InChI=1S/C18H22N2OS/c1-4-5-7-15-13(2)20-17-9-8-14(21-3)12-16(17)18(15)22-11-6-10-19/h8-9,12H,4-7,11H2,1-3H3
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1.69E+3n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human N-myristoyltransferase 1 using human pp60Src92-16 amino acids) as substrate


J Med Chem 55: 3578-82 (2012)


Article DOI: 10.1021/jm300040p
BindingDB Entry DOI: 10.7270/Q2BC40KN
More data for this
Ligand-Target Pair
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Homo sapiens (Human))
BDBM50134761
PNG
(CHEMBL3754347)
Show SMILES C(c1noc(n1)-c1cccnc1OC1CCNCC1)c1ccccc1
Show InChI InChI=1S/C19H20N4O2/c1-2-5-14(6-3-1)13-17-22-19(25-23-17)16-7-4-10-21-18(16)24-15-8-11-20-12-9-15/h1-7,10,15,20H,8-9,11-13H2
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1.70E+3n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human NMT1 by 7-diethylamine-3-(4'maleimidylphenyl)-4-methylcoumarin based fluorescence assay


Medchemcomm 6: 1767-1772 (2016)


Article DOI: 10.1039/c5md00242g
BindingDB Entry DOI: 10.7270/Q27M09RK
More data for this
Ligand-Target Pair
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Homo sapiens (Human))
BDBM50027681
PNG
(CHEMBL3357976)
Show SMILES OC[C@H]1CN(C[C@@H]1c1ccc(Cl)c(NC(=O)Cc2ccc(F)cc2)c1)C(=O)CC(O)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C29H29Cl2FN2O4/c30-22-6-1-18(2-7-22)11-24(36)14-29(38)34-15-21(17-35)25(16-34)20-5-10-26(31)27(13-20)33-28(37)12-19-3-8-23(32)9-4-19/h1-10,13,21,24-25,35-36H,11-12,14-17H2,(H,33,37)/t21-,24?,25-/m1/s1
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1.71E+3n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human NMT1 using GSNKSKPKDASQRRR-NH2 as substrate by CPM fluorescence assay


J Med Chem 57: 8664-70 (2014)


Article DOI: 10.1021/jm5011397
BindingDB Entry DOI: 10.7270/Q2X63PJN
More data for this
Ligand-Target Pair
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Homo sapiens (Human))
BDBM50134767
PNG
(CHEMBL3754003)
Show SMILES COc1ccc(OC2CCNCC2)c(c1)-c1nc(Cc2ccccc2)no1
Show InChI InChI=1S/C21H23N3O3/c1-25-17-7-8-19(26-16-9-11-22-12-10-16)18(14-17)21-23-20(24-27-21)13-15-5-3-2-4-6-15/h2-8,14,16,22H,9-13H2,1H3
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2.30E+3n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human NMT1 by 7-diethylamine-3-(4'maleimidylphenyl)-4-methylcoumarin based fluorescence assay


Medchemcomm 6: 1767-1772 (2016)


Article DOI: 10.1039/c5md00242g
BindingDB Entry DOI: 10.7270/Q27M09RK
More data for this
Ligand-Target Pair
Peptide N-myristoyltransferase


(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)


Article DOI: 10.1039/c5md00241a
BindingDB Entry DOI: 10.7270/Q2TB18R2
More data for this
Ligand-Target Pair
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(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 NMT1 after 10 to 20 mins by CPM fluorescence assay


J Med Chem 56: 371-5 (2013)


Article DOI: 10.1021/jm301474t
BindingDB Entry DOI: 10.7270/Q28S4R7S
More data for this
Ligand-Target Pair
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Homo sapiens (Human))
BDBM50423892
PNG
(CHEMBL2312447)
Show SMILES O=C(OCc1ccccc1)c1sc2ccccc2c1OC1CCNCC1
Show InChI InChI=1S/C21H21NO3S/c23-21(24-14-15-6-2-1-3-7-15)20-19(25-16-10-12-22-13-11-16)17-8-4-5-9-18(17)26-20/h1-9,16,22H,10-14H2
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4.41E+3n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Binding affinity to human NMT1 after 10 to 20 mins by CPM fluorescence assay


J Med Chem 56: 371-5 (2013)


Article DOI: 10.1021/jm301474t
BindingDB Entry DOI: 10.7270/Q28S4R7S
More data for this
Ligand-Target Pair
Peptide N-myristoyltransferase


(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)


Article DOI: 10.1039/c5md00241a
BindingDB Entry DOI: 10.7270/Q2TB18R2
More data for this
Ligand-Target Pair
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Homo sapiens (Human))
BDBM50423891
PNG
(CHEMBL2312448)
Show SMILES O=C(NCc1ccccc1)c1sc2ccccc2c1OC1CCNCC1
Show InChI InChI=1S/C21H22N2O2S/c24-21(23-14-15-6-2-1-3-7-15)20-19(25-16-10-12-22-13-11-16)17-8-4-5-9-18(17)26-20/h1-9,16,22H,10-14H2,(H,23,24)
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4.76E+3n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Binding affinity to human NMT1 after 10 to 20 mins by CPM fluorescence assay


J Med Chem 56: 371-5 (2013)


Article DOI: 10.1021/jm301474t
BindingDB Entry DOI: 10.7270/Q28S4R7S
More data for this
Ligand-Target Pair
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Homo sapiens (Human))
BDBM50134765
PNG
(CHEMBL3753135)
Show SMILES Fc1ccc(-c2nc(Cc3ccccc3)no2)c(OC2CCNCC2)c1
Show InChI InChI=1S/C20H20FN3O2/c21-15-6-7-17(18(13-15)25-16-8-10-22-11-9-16)20-23-19(24-26-20)12-14-4-2-1-3-5-14/h1-7,13,16,22H,8-12H2
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4.90E+3n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human NMT1 by 7-diethylamine-3-(4'maleimidylphenyl)-4-methylcoumarin based fluorescence assay


Medchemcomm 6: 1767-1772 (2016)


Article DOI: 10.1039/c5md00242g
BindingDB Entry DOI: 10.7270/Q27M09RK
More data for this
Ligand-Target Pair
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Homo sapiens (Human))
BDBM50027679
PNG
(CHEMBL3344389)
Show SMILES CC(=O)Nc1cc(ccc1Cl)[C@H]1CN(C[C@@H]1CO)C(=O)C[C@H](N)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C23H27Cl2N3O3/c1-14(30)27-22-9-16(4-7-21(22)25)20-12-28(11-17(20)13-29)23(31)10-19(26)8-15-2-5-18(24)6-3-15/h2-7,9,17,19-20,29H,8,10-13,26H2,1H3,(H,27,30)/t17-,19-,20-/m1/s1
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4.91E+3n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human NMT1 using GSNKSKPKDASQRRR-NH2 as substrate by CPM fluorescence assay


J Med Chem 57: 8664-70 (2014)


Article DOI: 10.1021/jm5011397
BindingDB Entry DOI: 10.7270/Q2X63PJN
More data for this
Ligand-Target Pair
Peptide N-myristoyltransferase


(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)


Article DOI: 10.1039/c5md00241a
BindingDB Entry DOI: 10.7270/Q2TB18R2
More data for this
Ligand-Target Pair
Peptide N-myristoyltransferase


(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)


Article DOI: 10.1039/c5md00241a
BindingDB Entry DOI: 10.7270/Q2TB18R2
More data for this
Ligand-Target Pair
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Homo sapiens (Human))
BDBM50384916
PNG
(CHEMBL2036504)
Show SMILES CCOC(=O)c1c(C)nc2ccccc2c1SCCC#N
Show InChI InChI=1S/C16H16N2O2S/c1-3-20-16(19)14-11(2)18-13-8-5-4-7-12(13)15(14)21-10-6-9-17/h4-5,7-8H,3,6,10H2,1-2H3
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1.08E+4n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human N-myristoyltransferase 1 using human pp60Src92-16 amino acids) as substrate


J Med Chem 55: 3578-82 (2012)


Article DOI: 10.1021/jm300040p
BindingDB Entry DOI: 10.7270/Q2BC40KN
More data for this
Ligand-Target Pair
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Homo sapiens (Human))
BDBM50027678
PNG
(CHEMBL3344388)
Show SMILES N[C@@H](CC(=O)N1C[C@@H](CO)[C@@H](C1)c1ccc(Cl)cc1)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C21H24Cl2N2O2/c22-17-5-1-14(2-6-17)9-19(24)10-21(27)25-11-16(13-26)20(12-25)15-3-7-18(23)8-4-15/h1-8,16,19-20,26H,9-13,24H2/t16-,19+,20-/m0/s1
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1.09E+4n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human NMT1 using GSNKSKPKDASQRRR-NH2 as substrate by CPM fluorescence assay


J Med Chem 57: 8664-70 (2014)


Article DOI: 10.1021/jm5011397
BindingDB Entry DOI: 10.7270/Q2X63PJN
More data for this
Ligand-Target Pair
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Homo sapiens (Human))
BDBM50134762
PNG
(CHEMBL3752013)
Show SMILES Fc1cccc(-c2nc(Cc3ccccc3)no2)c1OC1CCNCC1
Show InChI InChI=1S/C20H20FN3O2/c21-17-8-4-7-16(19(17)25-15-9-11-22-12-10-15)20-23-18(24-26-20)13-14-5-2-1-3-6-14/h1-8,15,22H,9-13H2
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1.50E+4n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human NMT1 by 7-diethylamine-3-(4'maleimidylphenyl)-4-methylcoumarin based fluorescence assay


Medchemcomm 6: 1767-1772 (2016)


Article DOI: 10.1039/c5md00242g
BindingDB Entry DOI: 10.7270/Q27M09RK
More data for this
Ligand-Target Pair
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Homo sapiens (Human))
BDBM50384911
PNG
(CHEMBL2036500)
Show SMILES CCc1c(C)nc2ccc(OC)cc2c1SCCC#N
Show InChI InChI=1S/C16H18N2OS/c1-4-13-11(2)18-15-7-6-12(19-3)10-14(15)16(13)20-9-5-8-17/h6-7,10H,4-5,9H2,1-3H3
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1.56E+4n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human N-myristoyltransferase 1 using human pp60Src92-16 amino acids) as substrate


J Med Chem 55: 3578-82 (2012)


Article DOI: 10.1021/jm300040p
BindingDB Entry DOI: 10.7270/Q2BC40KN
More data for this
Ligand-Target Pair
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Homo sapiens (Human))
BDBM50134766
PNG
(CHEMBL3753299)
Show SMILES Clc1ccc(-c2nc(Cc3ccccc3)no2)c(OC2CCNCC2)c1
Show InChI InChI=1S/C20H20ClN3O2/c21-15-6-7-17(18(13-15)25-16-8-10-22-11-9-16)20-23-19(24-26-20)12-14-4-2-1-3-5-14/h1-7,13,16,22H,8-12H2
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1.70E+4n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human NMT1 by 7-diethylamine-3-(4'maleimidylphenyl)-4-methylcoumarin based fluorescence assay


Medchemcomm 6: 1767-1772 (2016)


Article DOI: 10.1039/c5md00242g
BindingDB Entry DOI: 10.7270/Q27M09RK
More data for this
Ligand-Target Pair
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Homo sapiens (Human))
BDBM50384912
PNG
(CHEMBL2036502)
Show SMILES CCOC(=O)c1cnc2ccc(OC)cc2c1SCCC#N
Show InChI InChI=1S/C16H16N2O3S/c1-3-21-16(19)13-10-18-14-6-5-11(20-2)9-12(14)15(13)22-8-4-7-17/h5-6,9-10H,3-4,8H2,1-2H3
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1.94E+4n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human N-myristoyltransferase 1 using human pp60Src92-16 amino acids) as substrate


J Med Chem 55: 3578-82 (2012)


Article DOI: 10.1021/jm300040p
BindingDB Entry DOI: 10.7270/Q2BC40KN
More data for this
Ligand-Target Pair
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Homo sapiens (Human))
BDBM50384924
PNG
(CHEMBL2036637)
Show SMILES CCOC(=O)c1cnc2ccc(C)cc2c1SCCC#N
Show InChI InChI=1S/C16H16N2O2S/c1-3-20-16(19)13-10-18-14-6-5-11(2)9-12(14)15(13)21-8-4-7-17/h5-6,9-10H,3-4,8H2,1-2H3
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2.75E+4n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human N-myristoyltransferase 1 using human pp60Src92-16 amino acids) as substrate


J Med Chem 55: 3578-82 (2012)


Article DOI: 10.1021/jm300040p
BindingDB Entry DOI: 10.7270/Q2BC40KN
More data for this
Ligand-Target Pair
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Homo sapiens (Human))
BDBM50027676
PNG
(CHEMBL3344386)
Show SMILES Fc1ccc(CC(=O)Nc2ccc3[nH]cc(C4CCNCC4)c3c2)cc1
Show InChI InChI=1S/C21H22FN3O/c22-16-3-1-14(2-4-16)11-21(26)25-17-5-6-20-18(12-17)19(13-24-20)15-7-9-23-10-8-15/h1-6,12-13,15,23-24H,7-11H2,(H,25,26)
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2.85E+4n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human NMT1 using GSNKSKPKDASQRRR-NH2 as substrate by CPM fluorescence assay


J Med Chem 57: 8664-70 (2014)


Article DOI: 10.1021/jm5011397
BindingDB Entry DOI: 10.7270/Q2X63PJN
More data for this
Ligand-Target Pair
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Homo sapiens (Human))
BDBM50384923
PNG
(CHEMBL2036636)
Show SMILES CCOC(=O)c1cnc2ccc(F)cc2c1SCCC#N
Show InChI InChI=1S/C15H13FN2O2S/c1-2-20-15(19)12-9-18-13-5-4-10(16)8-11(13)14(12)21-7-3-6-17/h4-5,8-9H,2-3,7H2,1H3
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3.35E+4n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human N-myristoyltransferase 1 using human pp60Src92-16 amino acids) as substrate


J Med Chem 55: 3578-82 (2012)


Article DOI: 10.1021/jm300040p
BindingDB Entry DOI: 10.7270/Q2BC40KN
More data for this
Ligand-Target Pair
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Homo sapiens (Human))
BDBM50134763
PNG
(CHEMBL3754584)
Show SMILES C(c1noc(n1)-c1ccccc1OC1CCNCC1)c1ccccc1
Show InChI InChI=1S/C20H21N3O2/c1-2-6-15(7-3-1)14-19-22-20(25-23-19)17-8-4-5-9-18(17)24-16-10-12-21-13-11-16/h1-9,16,21H,10-14H2
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3.40E+4n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human NMT1 by 7-diethylamine-3-(4'maleimidylphenyl)-4-methylcoumarin based fluorescence assay


Medchemcomm 6: 1767-1772 (2016)


Article DOI: 10.1039/c5md00242g
BindingDB Entry DOI: 10.7270/Q27M09RK
More data for this
Ligand-Target Pair
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Homo sapiens (Human))
BDBM50134760
PNG
(CHEMBL3751916)
Show SMILES Cc1ccc(-c2nc(Cc3ccccc3)no2)c(OC2CCNCC2)c1
Show InChI InChI=1S/C21H23N3O2/c1-15-7-8-18(19(13-15)25-17-9-11-22-12-10-17)21-23-20(24-26-21)14-16-5-3-2-4-6-16/h2-8,13,17,22H,9-12,14H2,1H3
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4.40E+4n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human NMT1 by 7-diethylamine-3-(4'maleimidylphenyl)-4-methylcoumarin based fluorescence assay


Medchemcomm 6: 1767-1772 (2016)


Article DOI: 10.1039/c5md00242g
BindingDB Entry DOI: 10.7270/Q27M09RK
More data for this
Ligand-Target Pair
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Homo sapiens (Human))
BDBM50384920
PNG
(CHEMBL2036508)
Show SMILES CCCCc1c(C)nc2ccc(OC)cc2c1SCCCC#N
Show InChI InChI=1S/C19H24N2OS/c1-4-5-8-16-14(2)21-18-10-9-15(22-3)13-17(18)19(16)23-12-7-6-11-20/h9-10,13H,4-8,12H2,1-3H3
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4.76E+4n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human N-myristoyltransferase 1 using human pp60Src92-16 amino acids) as substrate


J Med Chem 55: 3578-82 (2012)


Article DOI: 10.1021/jm300040p
BindingDB Entry DOI: 10.7270/Q2BC40KN
More data for this
Ligand-Target Pair
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Homo sapiens (Human))
BDBM50384917
PNG
(CHEMBL2036505)
Show SMILES CCOC(=O)c1c(CC)nc2ccccc2c1SCCC#N
Show InChI InChI=1S/C17H18N2O2S/c1-3-13-15(17(20)21-4-2)16(22-11-7-10-18)12-8-5-6-9-14(12)19-13/h5-6,8-9H,3-4,7,11H2,1-2H3
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4.79E+4n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Inhibition of human N-myristoyltransferase 1 using human pp60Src92-16 amino acids) as substrate


J Med Chem 55: 3578-82 (2012)


Article DOI: 10.1021/jm300040p
BindingDB Entry DOI: 10.7270/Q2BC40KN
More data for this
Ligand-Target Pair
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