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PubMed code 16970390

Compile data set for download or QSAR
Found 6 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 2


(Homo sapiens (Human))
BDBM17446
PNG
((3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-m...)
Show SMILES [H][C@@]1([#6@H](-[#8]-[#6])-[#6@@H](-[#6]-[#6][C@]11[#6]-[#8]1)-[#8]-[#6](=O)-[#7]-[#6](=O)-[#6]Cl)[C@@]1([#6])[#8]-[#6@@H]1-[#6]\[#6]=[#6](\[#6])-[#6] |r|
Show InChI InChI=1S/C19H28ClNO6/c1-11(2)5-6-13-18(3,27-13)16-15(24-4)12(7-8-19(16)10-25-19)26-17(23)21-14(22)9-20/h5,12-13,15-16H,6-10H2,1-4H3,(H,21,22,23)/t12-,13-,15-,16-,18+,19+/m1/s1
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Article
PubMed
n/an/a 1n/an/an/an/an/an/a



The Johns Hopkins University School of Medicine

Curated by ChEMBL


Assay Description
Inhibition of human MetAP2


J Med Chem 49: 5645-8 (2006)


Article DOI: 10.1021/jm060559v
BindingDB Entry DOI: 10.7270/Q2PN959W
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Methionine aminopeptidase 2


(Homo sapiens (Human))
BDBM50194619
PNG
(6S-(1'R,2'R-1',5'-dimethyl-1',2'-oxiranyl-4'-hexen...)
Show SMILES [#6]-[#8][C@@]12[#6]([C@@]3([#6])[#8]-[#6@@H]3-[#6]\[#6]=[#6](\[#6])-[#6])[C@]1([#6]-[#8])[#6]-[#6]-[#6]2=O
Show InChI InChI=1S/C16H24O4/c1-10(2)5-6-12-14(3,20-12)13-15(9-17)8-7-11(18)16(13,15)19-4/h5,12-13,17H,6-9H2,1-4H3/t12-,13?,14+,15-,16+/m1/s1
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n/an/a 3.23E+3n/an/an/an/an/an/a



The Johns Hopkins University School of Medicine

Curated by ChEMBL


Assay Description
Inhibition of human MetAP2


J Med Chem 49: 5645-8 (2006)


Article DOI: 10.1021/jm060559v
BindingDB Entry DOI: 10.7270/Q2PN959W
More data for this
Ligand-Target Pair
Methionine aminopeptidase 2


(Homo sapiens (Human))
BDBM50194620
PNG
((1R,2S,3S)-1-hydroxy-3-methoxy-2-[(2R,3R)-2-methyl...)
Show SMILES [#6]-[#8]-[#6@H]-1-[#6@H]([C@@]2([#6])[#8]-[#6@@H]2-[#6]\[#6]=[#6](\[#6])-[#6])[C@]([#8])([#6]-[#6]-[#6]-1=O)[#6]=O
Show InChI InChI=1S/C16H24O5/c1-10(2)5-6-12-15(3,21-12)14-13(20-4)11(18)7-8-16(14,19)9-17/h5,9,12-14,19H,6-8H2,1-4H3/t12-,13-,14-,15+,16+/m1/s1
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n/an/a 8.00E+3n/an/an/an/an/an/a



The Johns Hopkins University School of Medicine

Curated by ChEMBL


Assay Description
Inhibition of human MetAP2


J Med Chem 49: 5645-8 (2006)


Article DOI: 10.1021/jm060559v
BindingDB Entry DOI: 10.7270/Q2PN959W
More data for this
Ligand-Target Pair
Methionine aminopeptidase 2


(Homo sapiens (Human))
BDBM50194621
PNG
(6S-(1'R,2'R-1',5'-dimethyl-1',2'-oxiranyl-4'-hexen...)
Show SMILES [#6]-[#8][C@@]12[#6]([C@@]3([#6])[#8]-[#6@@H]3-[#6]\[#6]=[#6](\[#6])-[#6])[C@@]1([#6]-[#6]-[#6]2=O)[#6]=O
Show InChI InChI=1S/C16H22O4/c1-10(2)5-6-12-14(3,20-12)13-15(9-17)8-7-11(18)16(13,15)19-4/h5,9,12-13H,6-8H2,1-4H3/t12-,13?,14+,15-,16+/m1/s1
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n/an/a 1.32E+4n/an/an/an/an/an/a



The Johns Hopkins University School of Medicine

Curated by ChEMBL


Assay Description
Inhibition of human MetAP2


J Med Chem 49: 5645-8 (2006)


Article DOI: 10.1021/jm060559v
BindingDB Entry DOI: 10.7270/Q2PN959W
More data for this
Ligand-Target Pair
Methionine aminopeptidase 2


(Homo sapiens (Human))
BDBM50194623
PNG
((1S,5S,6R,E)-5-(hydroxymethyl)-1-methoxy-6-(6-meth...)
Show SMILES [#6]-[#8][C@@]12[#6](\[#6](-[#6])=[#6]\[#6]\[#6]=[#6](\[#6])-[#6])[C@]1([#6]-[#8])[#6]-[#6]-[#6]2=O
Show InChI InChI=1S/C16H24O3/c1-11(2)6-5-7-12(3)14-15(10-17)9-8-13(18)16(14,15)19-4/h6-7,14,17H,5,8-10H2,1-4H3/b12-7+/t14?,15-,16+/m1/s1
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n/an/a 3.38E+4n/an/an/an/an/an/a



The Johns Hopkins University School of Medicine

Curated by ChEMBL


Assay Description
Inhibition of human MetAP2


J Med Chem 49: 5645-8 (2006)


Article DOI: 10.1021/jm060559v
BindingDB Entry DOI: 10.7270/Q2PN959W
More data for this
Ligand-Target Pair
Methionine aminopeptidase 2


(Homo sapiens (Human))
BDBM50194622
PNG
((1S,5S,6R)-5-(hydroxymethyl)-1-methoxy-6'-(6'-meth...)
Show SMILES [#6]-[#8][C@@]12[#6](-[#6](-[#6])-[#6]-[#6]\[#6]=[#6](\[#6])-[#6])[C@]1([#6]-[#8])[#6]-[#6]-[#6]2=O
Show InChI InChI=1S/C16H26O3/c1-11(2)6-5-7-12(3)14-15(10-17)9-8-13(18)16(14,15)19-4/h6,12,14,17H,5,7-10H2,1-4H3/t12?,14?,15-,16+/m1/s1
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n/an/a 5.75E+4n/an/an/an/an/an/a



The Johns Hopkins University School of Medicine

Curated by ChEMBL


Assay Description
Inhibition of human MetAP2


J Med Chem 49: 5645-8 (2006)


Article DOI: 10.1021/jm060559v
BindingDB Entry DOI: 10.7270/Q2PN959W
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%