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Compile Data Set for Download or QSAR

Found 20 hits of ph data with Target = 'Methionine Aminopeptidase (MAP)'   
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
Methionine Aminopeptidase (MAP)


(Escherichia coli (strain K12))
BDBM17853
PNG
(3,5-Pyrazolediamine Inhibitor, 3 | 3-imino-4-[(E)-...)
Show SMILES FC(F)(F)c1cccc(NN=c2c(=N)nnc2=N)c1
Show InChI InChI=1S/C10H7F3N6/c11-10(12,13)5-2-1-3-6(4-5)16-17-7-8(14)18-19-9(7)15/h1-4,14-16H
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n/an/a 250n/an/an/an/a7.530



The Procter & Gamble Pharmaceuticals



Assay Description
The inhibitory activity of a compound toward EcMAP was measured by incubating the compound at various concentrations in the presence of the enzyme an...


Proteins 66: 538-46 (2007)


Article DOI: 10.1002/prot.21207
BindingDB Entry DOI: 10.7270/Q2MK6B5Q
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Methionine Aminopeptidase (MAP)


(Staphylococcus aureus)
BDBM17872
PNG
(1,2,4-triazole derivative. | 3-(benzylsulfanyl)-4-...)
Show SMILES Cn1cnnc1SCc1ccccc1
Show InChI InChI=1S/C10H11N3S/c1-13-8-11-12-10(13)14-7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3
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n/an/a>1.00E+5n/an/an/an/a7.522



Morphochem AG



Assay Description
The MetAP reaction with Co2+ as a cofactor is coupled to a prolyl aminopeptidase (ProAP) using Met-Pro-p-nitroanilide as substrate. MetAP-catalyzed c...


J Mol Biol 332: 13-21 (2003)


BindingDB Entry DOI: 10.7270/Q2C53J49
More data for this
Ligand-Target Pair
Methionine Aminopeptidase (MAP)


(Escherichia coli (strain K12))
BDBM17855
PNG
(3,5-Pyrazolediamine Inhibitor, 5 | 4-[(E)-2-(3-flu...)
Show SMILES Fc1cccc(NN=c2c(=N)nnc2=N)c1
Show InChI InChI=1S/C9H7FN6/c10-5-2-1-3-6(4-5)13-14-7-8(11)15-16-9(7)12/h1-4,11-13H
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n/an/a 550n/an/an/an/a7.530



The Procter & Gamble Pharmaceuticals



Assay Description
The inhibitory activity of a compound toward EcMAP was measured by incubating the compound at various concentrations in the presence of the enzyme an...


Proteins 66: 538-46 (2007)


Article DOI: 10.1002/prot.21207
BindingDB Entry DOI: 10.7270/Q2MK6B5Q
More data for this
Ligand-Target Pair
Methionine Aminopeptidase (MAP)


(Escherichia coli (strain K12))
BDBM17856
PNG
(3,5-Pyrazolediamine Inhibitor, 6 | 4-[(E)-2-(3-chl...)
Show SMILES Cc1c(Cl)cccc1NN=c1c(=N)nnc1=N
Show InChI InChI=1S/C10H9ClN6/c1-5-6(11)3-2-4-7(5)14-15-8-9(12)16-17-10(8)13/h2-4,12-14H,1H3
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n/an/a 550n/an/an/an/a7.530



The Procter & Gamble Pharmaceuticals



Assay Description
The inhibitory activity of a compound toward EcMAP was measured by incubating the compound at various concentrations in the presence of the enzyme an...


Proteins 66: 538-46 (2007)


Article DOI: 10.1002/prot.21207
BindingDB Entry DOI: 10.7270/Q2MK6B5Q
More data for this
Ligand-Target Pair
Methionine Aminopeptidase (MAP)


(Escherichia coli (strain K12))
BDBM17857
PNG
(3,5-Pyrazolediamine Inhibitor, 7 | 4-[(E)-2-(4-flu...)
Show SMILES Fc1ccc(NN=c2c(=N)nnc2=N)cc1
Show InChI InChI=1S/C9H7FN6/c10-5-1-3-6(4-2-5)13-14-7-8(11)15-16-9(7)12/h1-4,11-13H
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n/an/a 580n/an/an/an/a7.530



The Procter & Gamble Pharmaceuticals



Assay Description
The inhibitory activity of a compound toward EcMAP was measured by incubating the compound at various concentrations in the presence of the enzyme an...


Proteins 66: 538-46 (2007)


Article DOI: 10.1002/prot.21207
BindingDB Entry DOI: 10.7270/Q2MK6B5Q
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Methionine Aminopeptidase (MAP)


(Escherichia coli (strain K12))
BDBM17858
PNG
(3,5-Pyrazolediamine Inhibitor, 8 | 4-[(E)-2-(4-chl...)
Show SMILES Clc1ccc(NN=c2c(=N)nnc2=N)cc1
Show InChI InChI=1S/C9H7ClN6/c10-5-1-3-6(4-2-5)13-14-7-8(11)15-16-9(7)12/h1-4,11-13H
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n/an/a 1.25E+3n/an/an/an/a7.530



The Procter & Gamble Pharmaceuticals



Assay Description
The inhibitory activity of a compound toward EcMAP was measured by incubating the compound at various concentrations in the presence of the enzyme an...


Proteins 66: 538-46 (2007)


Article DOI: 10.1002/prot.21207
BindingDB Entry DOI: 10.7270/Q2MK6B5Q
More data for this
Ligand-Target Pair
Methionine Aminopeptidase (MAP)


(Escherichia coli (strain K12))
BDBM17859
PNG
(3,5-Pyrazolediamine Inhibitor, 9 | 3-imino-4-[(E)-...)
Show SMILES COc1ccc(NN=c2c(=N)nnc2=N)cc1
Show InChI InChI=1S/C10H10N6O/c1-17-7-4-2-6(3-5-7)13-14-8-9(11)15-16-10(8)12/h2-5,11-13H,1H3
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n/an/a 1.50E+3n/an/an/an/a7.530



The Procter & Gamble Pharmaceuticals



Assay Description
The inhibitory activity of a compound toward EcMAP was measured by incubating the compound at various concentrations in the presence of the enzyme an...


Proteins 66: 538-46 (2007)


Article DOI: 10.1002/prot.21207
BindingDB Entry DOI: 10.7270/Q2MK6B5Q
More data for this
Ligand-Target Pair
Methionine Aminopeptidase (MAP)


(Escherichia coli (strain K12))
BDBM17860
PNG
(3,5-Pyrazolediamine Inhibitor, 2 | 3-[(E)-2-(5-ami...)
Show SMILES OC(=O)c1cccc(NN=c2c(=N)nnc2=N)c1
Show InChI InChI=1S/C10H8N6O2/c11-8-7(9(12)16-15-8)14-13-6-3-1-2-5(4-6)10(17)18/h1-4,11-13H,(H,17,18)
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n/an/a 1.75E+3n/an/an/an/a7.530



The Procter & Gamble Pharmaceuticals



Assay Description
The inhibitory activity of a compound toward EcMAP was measured by incubating the compound at various concentrations in the presence of the enzyme an...


Proteins 66: 538-46 (2007)


Article DOI: 10.1002/prot.21207
BindingDB Entry DOI: 10.7270/Q2MK6B5Q
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Methionine Aminopeptidase (MAP)


(Escherichia coli (strain K12))
BDBM17861
PNG
(3,5-Pyrazolediamine Inhibitor, 10 | 3-[(E)-2-(5-am...)
Show SMILES OC(=O)c1cccc(NN=c2c(=N)nnc2=N)c1O
Show InChI InChI=1S/C10H8N6O3/c11-8-6(9(12)16-15-8)14-13-5-3-1-2-4(7(5)17)10(18)19/h1-3,11-13,17H,(H,18,19)
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n/an/a 2.00E+3n/an/an/an/a7.530



The Procter & Gamble Pharmaceuticals



Assay Description
The inhibitory activity of a compound toward EcMAP was measured by incubating the compound at various concentrations in the presence of the enzyme an...


Proteins 66: 538-46 (2007)


Article DOI: 10.1002/prot.21207
BindingDB Entry DOI: 10.7270/Q2MK6B5Q
More data for this
Ligand-Target Pair
Methionine Aminopeptidase (MAP)


(Escherichia coli (strain K12))
BDBM17862
PNG
(({4-[(E)-2-(5-amino-3-imino-3H-pyrazol-4-yl)diazen...)
Show SMILES NC(N)=NNS(=O)(=O)c1ccc(NN=c2c(=N)nnc2=N)cc1
Show InChI InChI=1S/C10H12N10O2S/c11-8-7(9(12)18-17-8)16-15-5-1-3-6(4-2-5)23(21,22)20-19-10(13)14/h1-4,11-12,15,20H,(H4,13,14,19)
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n/an/a 2.00E+4n/an/an/an/a7.530



The Procter & Gamble Pharmaceuticals



Assay Description
The inhibitory activity of a compound toward EcMAP was measured by incubating the compound at various concentrations in the presence of the enzyme an...


Proteins 66: 538-46 (2007)


Article DOI: 10.1002/prot.21207
BindingDB Entry DOI: 10.7270/Q2MK6B5Q
More data for this
Ligand-Target Pair
Methionine Aminopeptidase (MAP)


(Escherichia coli (strain K12))
BDBM17863
PNG
(Amino-Alcohol Inhibitor, 12 | methyl 2-[(2S)-2-[(2...)
Show SMILES COC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](O)[C@H](N)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C16H20F3N3O5/c1-8(14(25)21-7-11(23)27-2)22-15(26)13(24)12(20)9-3-5-10(6-4-9)16(17,18)19/h3-6,8,12-13,24H,7,20H2,1-2H3,(H,21,25)(H,22,26)/t8-,12+,13-/m0/s1
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n/an/a 1.70E+3n/an/an/an/a7.530



The Procter & Gamble Pharmaceuticals



Assay Description
The inhibitory activity of a compound toward EcMAP was measured by incubating the compound at various concentrations in the presence of the enzyme an...


Proteins 66: 538-46 (2007)


Article DOI: 10.1002/prot.21207
BindingDB Entry DOI: 10.7270/Q2MK6B5Q
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Methionine Aminopeptidase (MAP)


(Escherichia coli (strain K12))
BDBM17864
PNG
(Amino-Alcohol Inhibitor, 13 | methyl (2S)-2-[(2S)-...)
Show SMILES COC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H](O)[C@H](N)c1ccc(cc1)C(C)C
Show InChI InChI=1S/C22H35N3O5/c1-12(2)11-17(22(29)30-6)25-20(27)14(5)24-21(28)19(26)18(23)16-9-7-15(8-10-16)13(3)4/h7-10,12-14,17-19,26H,11,23H2,1-6H3,(H,24,28)(H,25,27)/t14-,17-,18+,19-/m0/s1
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n/an/a 3.50E+3n/an/an/an/a7.530



The Procter & Gamble Pharmaceuticals



Assay Description
The inhibitory activity of a compound toward EcMAP was measured by incubating the compound at various concentrations in the presence of the enzyme an...


Proteins 66: 538-46 (2007)


Article DOI: 10.1002/prot.21207
BindingDB Entry DOI: 10.7270/Q2MK6B5Q
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Methionine Aminopeptidase (MAP)


(Escherichia coli (strain K12))
BDBM17865
PNG
(Amino-Alcohol Inhibitor, 14 | methyl (2S)-2-[(2S)-...)
Show SMILES CCCC[C@@H](N)[C@H](O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)OC
Show InChI InChI=1S/C17H33N3O6/c1-5-6-7-11(18)14(22)16(24)20-13(9-21)15(23)19-12(8-10(2)3)17(25)26-4/h10-14,21-22H,5-9,18H2,1-4H3,(H,19,23)(H,20,24)/t11-,12+,13+,14+/m1/s1
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n/an/a 1.20E+4n/an/an/an/a7.530



The Procter & Gamble Pharmaceuticals



Assay Description
The inhibitory activity of a compound toward EcMAP was measured by incubating the compound at various concentrations in the presence of the enzyme an...


Proteins 66: 538-46 (2007)


Article DOI: 10.1002/prot.21207
BindingDB Entry DOI: 10.7270/Q2MK6B5Q
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Methionine Aminopeptidase (MAP)


(Escherichia coli (strain K12))
BDBM17866
PNG
(Amino-Alcohol Inhibitor, 15 | methyl (2S)-2-[(2S)-...)
Show SMILES COC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H](O)[C@H](N)c1ccc(C)cc1
Show InChI InChI=1S/C20H31N3O5/c1-11(2)10-15(20(27)28-5)23-18(25)13(4)22-19(26)17(24)16(21)14-8-6-12(3)7-9-14/h6-9,11,13,15-17,24H,10,21H2,1-5H3,(H,22,26)(H,23,25)/t13-,15-,16+,17-/m0/s1
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n/an/a 2.50E+4n/an/an/an/a7.530



The Procter & Gamble Pharmaceuticals



Assay Description
The inhibitory activity of a compound toward EcMAP was measured by incubating the compound at various concentrations in the presence of the enzyme an...


Proteins 66: 538-46 (2007)


Article DOI: 10.1002/prot.21207
BindingDB Entry DOI: 10.7270/Q2MK6B5Q
More data for this
Ligand-Target Pair
Methionine Aminopeptidase (MAP)


(Staphylococcus aureus)
BDBM17867
PNG
((2S)-2-amino-4-(methylsulfanyl)-1-(1,3-thiazol-2-y...)
Show SMILES CSCC[C@H](N)C(=O)c1nccs1
Show InChI InChI=1S/C8H12N2OS2/c1-12-4-2-6(9)7(11)8-10-3-5-13-8/h3,5-6H,2,4,9H2,1H3/t6-/m0/s1
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n/an/a 1.90E+4n/an/an/an/a7.522



Morphochem AG



Assay Description
The MetAP reaction with Co2+ as a cofactor is coupled to a prolyl aminopeptidase (ProAP) using Met-Pro-p-nitroanilide as substrate. MetAP-catalyzed c...


J Med Chem 47: 1325-8 (2004)


Article DOI: 10.1021/jm034188j
BindingDB Entry DOI: 10.7270/Q2GX48TV
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Methionine Aminopeptidase (MAP)


(Staphylococcus aureus)
BDBM17868
PNG
((2S)-2-amino-4-(methylsulfanyl)-1-(pyridin-2-yl)bu...)
Show SMILES CSCC[C@H](N)C(=O)c1ccccn1
Show InChI InChI=1S/C10H14N2OS/c1-14-7-5-8(11)10(13)9-4-2-3-6-12-9/h2-4,6,8H,5,7,11H2,1H3/t8-/m0/s1
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n/an/a 1.60E+4n/an/an/an/a7.522



Morphochem AG



Assay Description
The MetAP reaction with Co2+ as a cofactor is coupled to a prolyl aminopeptidase (ProAP) using Met-Pro-p-nitroanilide as substrate. MetAP-catalyzed c...


J Med Chem 47: 1325-8 (2004)


Article DOI: 10.1021/jm034188j
BindingDB Entry DOI: 10.7270/Q2GX48TV
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Methionine Aminopeptidase (MAP)


(Staphylococcus aureus)
BDBM17869
PNG
((3S)-3-amino-1-(cyclopropylamino)heptane-2,2-diol ...)
Show SMILES CCCC[C@H](N)C(=O)CNC1CC1
Show InChI InChI=1S/C10H20N2O/c1-2-3-4-9(11)10(13)7-12-8-5-6-8/h8-9,12H,2-7,11H2,1H3/t9-/m0/s1
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n/an/a 7.00E+3n/an/an/an/a7.522



Morphochem AG



Assay Description
The MetAP reaction with Co2+ as a cofactor is coupled to a prolyl aminopeptidase (ProAP) using Met-Pro-p-nitroanilide as substrate. MetAP-catalyzed c...


J Med Chem 47: 1325-8 (2004)


Article DOI: 10.1021/jm034188j
BindingDB Entry DOI: 10.7270/Q2GX48TV
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Methionine Aminopeptidase (MAP)


(Staphylococcus aureus)
BDBM17870
PNG
(1,2,4-triazole derivative. | 5-(benzylsulfanyl)-4H...)
Show SMILES Nc1nnc(SCc2ccccc2)[nH]1
Show InChI InChI=1S/C9H10N4S/c10-8-11-9(13-12-8)14-6-7-4-2-1-3-5-7/h1-5H,6H2,(H3,10,11,12,13)
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n/an/a 599n/an/an/an/a7.522



Morphochem AG



Assay Description
The MetAP reaction with Co2+ as a cofactor is coupled to a prolyl aminopeptidase (ProAP) using Met-Pro-p-nitroanilide as substrate. MetAP-catalyzed c...


J Mol Biol 332: 13-21 (2003)


BindingDB Entry DOI: 10.7270/Q2C53J49
More data for this
Ligand-Target Pair
Methionine Aminopeptidase (MAP)


(Staphylococcus aureus)
BDBM17871
PNG
((1S)-1-[5-(benzylsulfanyl)-4H-1,2,4-triazol-3-yl]-...)
Show SMILES CSCC[C@H](N)c1nnc(SCc2ccccc2)[nH]1
Show InChI InChI=1S/C13H18N4S2/c1-18-8-7-11(14)12-15-13(17-16-12)19-9-10-5-3-2-4-6-10/h2-6,11H,7-9,14H2,1H3,(H,15,16,17)/t11-/m0/s1
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n/an/a 43.7n/an/an/an/a7.522



Morphochem AG



Assay Description
The MetAP reaction with Co2+ as a cofactor is coupled to a prolyl aminopeptidase (ProAP) using Met-Pro-p-nitroanilide as substrate. MetAP-catalyzed c...


J Mol Biol 332: 13-21 (2003)


BindingDB Entry DOI: 10.7270/Q2C53J49
More data for this
Ligand-Target Pair
Methionine Aminopeptidase (MAP)


(Escherichia coli (strain K12))
BDBM17854
PNG
(3,5-Pyrazolediamine Inhibitor, 4 | 3-imino-4-[(E)-...)
Show SMILES FC(F)(F)c1ccccc1NN=c1c(=N)nnc1=N
Show InChI InChI=1S/C10H7F3N6/c11-10(12,13)5-3-1-2-4-6(5)16-17-7-8(14)18-19-9(7)15/h1-4,14-16H
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n/an/a 250n/an/an/an/a7.530



The Procter & Gamble Pharmaceuticals



Assay Description
The inhibitory activity of a compound toward EcMAP was measured by incubating the compound at various concentrations in the presence of the enzyme an...


Proteins 66: 538-46 (2007)


Article DOI: 10.1002/prot.21207
BindingDB Entry DOI: 10.7270/Q2MK6B5Q
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)