BindingDB logo
myBDB logout

PubMed code 17120228

Compile data set for download or QSAR
Found 14 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Methionine aminopeptidase


(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 |(.72,8.79,;2.05,8.02,;2.82,9.36,;3.38,7.25,;1.28,6.69,;2.05,5.36,;1.28,4.02,;-.26,4.02,;-1.03,5.36,;-2.57,5.36,;-3.34,4.02,;-4.88,4.02,;-6.13,4.93,;-6.13,6.47,;-7.37,4.02,;-6.9,2.56,;-5.35,2.56,;-4.45,1.31,;-.26,6.69,)|
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
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
PDB
UniChem
PDB
Article
PubMed
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


(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 |(-1.8,9.36,;-1.03,8.02,;.3,8.79,;-2.36,7.25,;-.26,6.69,;1.28,6.69,;2.05,5.36,;1.28,4.02,;-.26,4.02,;-1.03,5.36,;-2.57,5.36,;-3.34,4.02,;-4.88,4.02,;-6.13,4.93,;-6.13,6.47,;-7.37,4.02,;-6.9,2.56,;-5.35,2.56,;-4.45,1.31,)|
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
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
PDB
UniChem
PDB
Article
PubMed
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


(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 |(-1.03,8.02,;-.26,6.69,;1.28,6.69,;2.05,8.02,;2.05,5.36,;1.28,4.02,;-.26,4.02,;-1.03,5.36,;-2.57,5.36,;-3.34,4.02,;-4.88,4.02,;-6.13,4.93,;-6.13,6.47,;-7.37,4.02,;-6.9,2.56,;-5.35,2.56,;-4.45,1.31,)|
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
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
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


(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 |(2.05,8.02,;1.28,6.69,;2.05,5.36,;1.28,4.02,;-.26,4.02,;-1.03,5.36,;-2.57,5.36,;-3.34,4.02,;-4.88,4.02,;-6.13,4.93,;-6.13,6.47,;-7.37,4.02,;-6.9,2.56,;-5.35,2.56,;-4.45,1.31,;-.26,6.69,)|
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
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
Article
PubMed
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


(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 |(3.59,5.36,;2.05,5.36,;1.28,6.69,;-.26,6.69,;-1.03,5.36,;-2.57,5.36,;-3.34,4.02,;-4.88,4.02,;-6.13,4.93,;-6.13,6.47,;-7.37,4.02,;-6.9,2.56,;-5.35,2.56,;-4.45,1.31,;-.26,4.02,;1.28,4.02,)|
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
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
PDB
UniChem

Similars
PDB
Article
PubMed
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


(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 |(3.59,5.36,;2.05,5.36,;1.28,6.69,;-.26,6.69,;-1.03,5.36,;-2.57,5.36,;-3.34,4.02,;-4.88,4.02,;-6.13,4.93,;-6.13,6.47,;-7.37,4.02,;-6.9,2.56,;-5.35,2.56,;-4.45,1.31,;-.26,4.02,;1.28,4.02,)|
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
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
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


(Escherichia coli (strain K12))		BDBM17859
PNG
(3,5-Pyrazolediamine Inhibitor, 9 | 3-imino-4-[(E)-...)
Show SMILES COc1ccc(NN=c2c(=N)nnc2=N)cc1 |(4.36,4.02,;3.59,5.36,;2.05,5.36,;1.28,6.69,;-.26,6.69,;-1.03,5.36,;-2.57,5.36,;-3.34,4.02,;-4.88,4.02,;-6.13,4.93,;-6.13,6.47,;-7.37,4.02,;-6.9,2.56,;-5.35,2.56,;-4.45,1.31,;-.26,4.02,;1.28,4.02,)|
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
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
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


(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 |r|
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
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
MMDB
PC cid
PC sid
PDB
UniChem

Similars
MMDB
PDB
Article
PubMed
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


(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 |(1.28,9.36,;2.05,8.02,;3.59,8.02,;1.28,6.69,;2.05,5.36,;1.28,4.02,;-.26,4.02,;-1.03,5.36,;-2.57,5.36,;-3.34,4.02,;-4.88,4.02,;-6.13,4.93,;-6.13,6.47,;-7.37,4.02,;-6.9,2.56,;-5.35,2.56,;-4.45,1.31,;-.26,6.69,)|
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)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
PDB
UniChem

Similars
PDB
Article
PubMed
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


(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 |(1.28,9.36,;2.05,8.02,;3.59,8.02,;1.28,6.69,;2.05,5.36,;1.28,4.02,;-.26,4.02,;-1.03,5.36,;-2.57,5.36,;-3.34,4.02,;-4.88,4.02,;-6.13,4.93,;-6.13,6.47,;-7.37,4.02,;-6.9,2.56,;-5.35,2.56,;-4.45,1.31,;-.26,6.69,;-1.03,8.02,)|
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)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
Article
PubMed
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


(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 |r|
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
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
PDB
UniChem

Similars
PDB
Article
PubMed
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


(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 |r|
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
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
PDB
UniChem

Similars
PDB
Article
PubMed
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


(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 |(5.9,6.69,;6.67,5.36,;8.21,5.36,;5.9,4.02,;4.36,4.02,;3.59,5.36,;3.19,6.84,;5.08,5.75,;2.05,5.36,;1.28,6.69,;-.26,6.69,;-1.03,5.36,;-2.57,5.36,;-3.34,4.02,;-4.88,4.02,;-6.13,4.93,;-6.13,6.47,;-7.37,4.02,;-6.9,2.56,;-5.35,2.56,;-4.45,1.31,;-.26,4.02,;1.28,4.02,)|
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)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
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


(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 |r|
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
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
PDB
UniChem

Similars
PDB
Article
PubMed
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		3D
3D Structure (crystal)
* indicates data uncertainty>20%