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Compile Data Set for Download or QSAR

Found 77 hits Enz. Inhib. hit(s) with all data for entry = 643   
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
Neuraminidase


(Influenza A virus (N9))
BDBM4758
PNG
((3S,4S)-3-carbamimidamido-4-[(S)-(diethylcarbamoyl...)
Show SMILES [#6]-[#6]-[#7](-[#6]-[#6])-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:14.21,7.7|
Show InChI InChI=1S/C15H27N5O4/c1-4-20(5-2)13(22)12(18-8(3)21)10-6-9(14(23)24)7-11(10)19-15(16)17/h9-12H,4-7H2,1-3H3,(H,18,21)(H,23,24)(H4,16,17,19)/t9?,10-,11-,12?/m0/s1
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n/an/a 15n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4775
PNG
((3S,4S)-3-carbamimidamido-4-[(1S)-1-acetamido-2-(m...)
Show SMILES [#6]-[#6](=O)-[#7]-[#6](-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O)-[#6](=O)-[#7]-1-[#6]-[#6]-[#8]-[#6]-[#6]-1 |r,w:7.14,4.3|
Show InChI InChI=1S/C15H25N5O5/c1-8(21)18-12(13(22)20-2-4-25-5-3-20)10-6-9(14(23)24)7-11(10)19-15(16)17/h9-12H,2-7H2,1H3,(H,18,21)(H,23,24)(H4,16,17,19)/t9?,10-,11-,12?/m0/s1
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n/an/a 40n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4764
PNG
((3S,4S)-3-carbamimidamido-4-[(S)-(dipropylcarbamoy...)
Show SMILES [#6]-[#6]-[#6]-[#7](-[#6]-[#6]-[#6])-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:16.23,9.9|
Show InChI InChI=1S/C17H31N5O4/c1-4-6-22(7-5-2)15(24)14(20-10(3)23)12-8-11(16(25)26)9-13(12)21-17(18)19/h11-14H,4-9H2,1-3H3,(H,20,23)(H,25,26)(H4,18,19,21)/t11?,12-,13-,14?/m0/s1
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n/an/a 60n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4743
PNG
((3S,4S)-3-carbamimidamido-4-[(S)-acetamido(pentan-...)
Show SMILES [#6]-[#6]-[#6](-[#6]-[#6])-[#7]-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:15.22,8.8|
Show InChI InChI=1S/C16H29N5O4/c1-4-10(5-2)20-14(23)13(19-8(3)22)11-6-9(15(24)25)7-12(11)21-16(17)18/h9-13H,4-7H2,1-3H3,(H,19,22)(H,20,23)(H,24,25)(H4,17,18,21)/t9?,11-,12-,13?/m0/s1
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n/an/a 80n/an/an/an/a6.537



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4759
PNG
((3S,4S)-3-carbamimidamido-4-[(S)-acetamido[ethyl(p...)
Show SMILES [#6]-[#6]-[#6]-[#7](-[#6]-[#6])-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:15.22,8.8|
Show InChI InChI=1S/C16H29N5O4/c1-4-6-21(5-2)14(23)13(19-9(3)22)11-7-10(15(24)25)8-12(11)20-16(17)18/h10-13H,4-8H2,1-3H3,(H,19,22)(H,24,25)(H4,17,18,20)/t10?,11-,12-,13?/m0/s1
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n/an/a 130n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4767
PNG
((3S,4S)-3-carbamimidamido-4-[(1S)-1-acetamido-2-ox...)
Show SMILES [#6]-[#6](=O)-[#7]-[#6](-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O)-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6]-[#6]-1 |r,w:7.14,4.3|
Show InChI InChI=1S/C16H27N5O4/c1-9(22)19-13(14(23)21-5-3-2-4-6-21)11-7-10(15(24)25)8-12(11)20-16(17)18/h10-13H,2-8H2,1H3,(H,19,22)(H,24,25)(H4,17,18,20)/t10?,11-,12-,13?/m0/s1
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n/an/a 150n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4771
PNG
((3S,4S)-3-carbamimidamido-4-[(1S)-1-acetamido-2-ox...)
Show SMILES [#6]-[#6]-[#6]-[#6]-1-[#6]-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:18.26,11.12|
Show InChI InChI=1S/C19H33N5O4/c1-3-6-13-7-4-5-8-24(13)17(26)16(22-11(2)25)14-9-12(18(27)28)10-15(14)23-19(20)21/h12-16H,3-10H2,1-2H3,(H,22,25)(H,27,28)(H4,20,21,23)/t12?,13?,14-,15-,16?/m0/s1
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n/an/a 150n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4770
PNG
((3S,4S)-3-carbamimidamido-4-[(1S)-1-acetamido-2-(2...)
Show SMILES [#6]-[#6]-[#6]-1-[#6]-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:17.25,10.11|
Show InChI InChI=1S/C18H31N5O4/c1-3-12-6-4-5-7-23(12)16(25)15(21-10(2)24)13-8-11(17(26)27)9-14(13)22-18(19)20/h11-15H,3-9H2,1-2H3,(H,21,24)(H,26,27)(H4,19,20,22)/t11?,12?,13-,14-,15?/m0/s1
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n/an/a 180n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4763
PNG
((3S,4S)-3-carbamimidamido-4-[(S)-[(cyclopropylmeth...)
Show SMILES [#6]-[#6]-[#6]-[#7](-[#6]-[#6]-1-[#6]-[#6]-1)-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:17.25,10.11|
Show InChI InChI=1S/C18H31N5O4/c1-3-6-23(9-11-4-5-11)16(25)15(21-10(2)24)13-7-12(17(26)27)8-14(13)22-18(19)20/h11-15H,3-9H2,1-2H3,(H,21,24)(H,26,27)(H4,19,20,22)/t12?,13-,14-,15?/m0/s1
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n/an/a 200n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4776
PNG
((3S,4S)-3-carbamimidamido-4-[(1S)-1-acetamido-2-ox...)
Show SMILES [#6]-[#6](=O)-[#7]-[#6](-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O)-[#6](=O)-[#7]-1-[#6]-[#6]-[#16]-[#6]-[#6]-1 |r,w:7.14,4.3|
Show InChI InChI=1S/C15H25N5O4S/c1-8(21)18-12(13(22)20-2-4-25-5-3-20)10-6-9(14(23)24)7-11(10)19-15(16)17/h9-12H,2-7H2,1H3,(H,18,21)(H,23,24)(H4,16,17,19)/t9?,10-,11-,12?/m0/s1
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n/an/a 230n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4749
PNG
((3S,4S)-3-carbamimidamido-4-[(S)-acetamido[(4-phen...)
Show SMILES [#6]-[#6](-[#6]-[#6]-c1ccccc1)-[#7]-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:20.28,13.14|
Show InChI InChI=1S/C21H31N5O4/c1-12(8-9-14-6-4-3-5-7-14)24-19(28)18(25-13(2)27)16-10-15(20(29)30)11-17(16)26-21(22)23/h3-7,12,15-18H,8-11H2,1-2H3,(H,24,28)(H,25,27)(H,29,30)(H4,22,23,26)/t12?,15?,16-,17-,18?/m0/s1
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n/an/a 230n/an/an/an/a6.537



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4769
PNG
((3S,4S)-3-carbamimidamido-4-[(1S)-1-acetamido-2-(2...)
Show SMILES [#6]-[#6]-1-[#6]-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:16.24,9.10|
Show InChI InChI=1S/C17H29N5O4/c1-9-5-3-4-6-22(9)15(24)14(20-10(2)23)12-7-11(16(25)26)8-13(12)21-17(18)19/h9,11-14H,3-8H2,1-2H3,(H,20,23)(H,25,26)(H4,18,19,21)/t9?,11?,12-,13-,14?/m0/s1
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n/an/a 240n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4738
PNG
((3S,4S)-3-carbamimidamido-4-[(S)-acetamido(ethylca...)
Show SMILES [#6]-[#6]-[#7]-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:12.19,5.5|
Show InChI InChI=1S/C13H23N5O4/c1-3-16-11(20)10(17-6(2)19)8-4-7(12(21)22)5-9(8)18-13(14)15/h7-10H,3-5H2,1-2H3,(H,16,20)(H,17,19)(H,21,22)(H4,14,15,18)/t7?,8-,9-,10?/m0/s1
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n/an/a 330n/an/an/an/a6.537



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4742
PNG
((3S,4S)-3-[(S)-(butan-2-ylcarbamoyl)(acetamido)met...)
Show SMILES [#6]-[#6]-[#6](-[#6])-[#7]-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:14.21,7.7|
Show InChI InChI=1S/C15H27N5O4/c1-4-7(2)18-13(22)12(19-8(3)21)10-5-9(14(23)24)6-11(10)20-15(16)17/h7,9-12H,4-6H2,1-3H3,(H,18,22)(H,19,21)(H,23,24)(H4,16,17,20)/t7?,9?,10-,11-,12?/m0/s1
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n/an/a 410n/an/an/an/a6.537



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4760
PNG
((3S,4S)-3-[(S)-[butyl(ethyl)carbamoyl](acetamido)m...)
Show SMILES [#6]-[#6]-[#6]-[#6]-[#7](-[#6]-[#6])-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:16.23,9.9|
Show InChI InChI=1S/C17H31N5O4/c1-4-6-7-22(5-2)15(24)14(20-10(3)23)12-8-11(16(25)26)9-13(12)21-17(18)19/h11-14H,4-9H2,1-3H3,(H,20,23)(H,25,26)(H4,18,19,21)/t11?,12-,13-,14?/m0/s1
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n/an/a 430n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4766
PNG
((3S,4S)-3-carbamimidamido-4-[(1S)-1-acetamido-2-ox...)
Show SMILES [#6]-[#6](=O)-[#7]-[#6](-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O)-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6]-1 |r,w:7.14,4.3|
Show InChI InChI=1S/C15H25N5O4/c1-8(21)18-12(13(22)20-4-2-3-5-20)10-6-9(14(23)24)7-11(10)19-15(16)17/h9-12H,2-7H2,1H3,(H,18,21)(H,23,24)(H4,16,17,19)/t9?,10-,11-,12?/m0/s1
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n/an/a 470n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4754
PNG
((3S,4S)-3-carbamimidamido-4-[(S)-acetamido[methyl(...)
Show SMILES [#6]-[#7](-[#6]-[#6]=[#6])-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:14.21,7.7|
Show InChI InChI=1S/C15H25N5O4/c1-4-5-20(3)13(22)12(18-8(2)21)10-6-9(14(23)24)7-11(10)19-15(16)17/h4,9-12H,1,5-7H2,2-3H3,(H,18,21)(H,23,24)(H4,16,17,19)/t9?,10-,11-,12?/m0/s1
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n/an/a 650n/an/an/an/a6.537



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4761
PNG
((3S,4S)-3-[(S)-[benzyl(ethyl)carbamoyl](acetamido)...)
Show SMILES [#6]-[#6]-[#7](-[#6]-c1ccccc1)-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:19.27,12.13|
Show InChI InChI=1S/C20H29N5O4/c1-3-25(11-13-7-5-4-6-8-13)18(27)17(23-12(2)26)15-9-14(19(28)29)10-16(15)24-20(21)22/h4-8,14-17H,3,9-11H2,1-2H3,(H,23,26)(H,28,29)(H4,21,22,24)/t14?,15-,16-,17?/m0/s1
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n/an/a 670n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4740
PNG
((3S,4S)-3-carbamimidamido-4-[(S)-acetamido(prop-2-...)
Show SMILES [#6]-[#6](=O)-[#7]-[#6](-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6]-[#6]=[#6] |r,w:7.14,4.3|
Show InChI InChI=1S/C14H23N5O4/c1-3-4-17-12(21)11(18-7(2)20)9-5-8(13(22)23)6-10(9)19-14(15)16/h3,8-11H,1,4-6H2,2H3,(H,17,21)(H,18,20)(H,22,23)(H4,15,16,19)/t8?,9-,10-,11?/m0/s1
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n/an/a 720n/an/an/an/a6.537



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4762
PNG
((3S,4S)-3-carbamimidamido-4-[(S)-acetamido[ethyl(2...)
Show SMILES [#6]-[#6]-[#7](-[#6]-[#6]-[#8])-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:15.22,8.8|
Show InChI InChI=1S/C15H27N5O5/c1-3-20(4-5-21)13(23)12(18-8(2)22)10-6-9(14(24)25)7-11(10)19-15(16)17/h9-12,21H,3-7H2,1-2H3,(H,18,22)(H,24,25)(H4,16,17,19)/t9?,10-,11-,12?/m0/s1
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n/an/a 720n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4765
PNG
((3S,4S)-3-[(1S)-2-(azetidin-1-yl)-1-acetamido-2-ox...)
Show SMILES [#6]-[#6](=O)-[#7]-[#6](-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O)-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-1 |r,w:7.14,4.3|
Show InChI InChI=1S/C14H23N5O4/c1-7(20)17-11(12(21)19-3-2-4-19)9-5-8(13(22)23)6-10(9)18-14(15)16/h8-11H,2-6H2,1H3,(H,17,20)(H,22,23)(H4,15,16,18)/t8?,9-,10-,11?/m0/s1
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n/an/a 920n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4752
PNG
((3S,4S)-3-carbamimidamido-4-[(S)-acetamido[methyl(...)
Show SMILES [#6]-[#6]-[#6]-[#7](-[#6])-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:14.21,7.7|
Show InChI InChI=1S/C15H27N5O4/c1-4-5-20(3)13(22)12(18-8(2)21)10-6-9(14(23)24)7-11(10)19-15(16)17/h9-12H,4-7H2,1-3H3,(H,18,21)(H,23,24)(H4,16,17,19)/t9?,10-,11-,12?/m0/s1
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n/an/a 940n/an/an/an/a6.537



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4768
PNG
((3S,4S)-3-[(1S)-2-(azepan-1-yl)-1-acetamido-2-oxoe...)
Show SMILES [#6]-[#6](=O)-[#7]-[#6](-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O)-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-1 |r,w:7.14,4.3|
Show InChI InChI=1S/C17H29N5O4/c1-10(23)20-14(15(24)22-6-4-2-3-5-7-22)12-8-11(16(25)26)9-13(12)21-17(18)19/h11-14H,2-9H2,1H3,(H,20,23)(H,25,26)(H4,18,19,21)/t11?,12-,13-,14?/m0/s1
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n/an/a 990n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4739
PNG
((3S,4S)-3-carbamimidamido-4-[(S)-acetamido(propan-...)
Show SMILES [#6]-[#6](-[#6])-[#7]-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:13.20,6.6|
Show InChI InChI=1S/C14H25N5O4/c1-6(2)17-12(21)11(18-7(3)20)9-4-8(13(22)23)5-10(9)19-14(15)16/h6,8-11H,4-5H2,1-3H3,(H,17,21)(H,18,20)(H,22,23)(H4,15,16,19)/t8?,9-,10-,11?/m0/s1
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n/an/a 1.34E+3n/an/an/an/a6.537



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4747
PNG
((3S,4S)-3-carbamimidamido-4-[(S)-acetamido(heptan-...)
Show SMILES [#6]-[#6]-[#6]-[#6]-[#6](-[#6]-[#6])-[#7]-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:17.24,10.10|
Show InChI InChI=1S/C18H33N5O4/c1-4-6-7-12(5-2)22-16(25)15(21-10(3)24)13-8-11(17(26)27)9-14(13)23-18(19)20/h11-15H,4-9H2,1-3H3,(H,21,24)(H,22,25)(H,26,27)(H4,19,20,23)/t11?,12?,13-,14-,15?/m0/s1
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n/an/a 1.80E+3n/an/an/an/a6.537



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4751
PNG
((3S,4S)-3-carbamimidamido-4-[(S)-acetamido[(1-meth...)
Show SMILES [#6]-[#6]-[#6](-[#6]-[#8]-[#6])-[#7]-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:16.23,9.9|
Show InChI InChI=1S/C16H29N5O5/c1-4-10(7-26-3)20-14(23)13(19-8(2)22)11-5-9(15(24)25)6-12(11)21-16(17)18/h9-13H,4-7H2,1-3H3,(H,19,22)(H,20,23)(H,24,25)(H4,17,18,21)/t9?,10?,11-,12-,13?/m0/s1
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n/an/a 2.20E+3n/an/an/an/a6.537



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4755
PNG
((3S,4S)-3-[(S)-[butyl(methyl)carbamoyl](acetamido)...)
Show SMILES [#6]-[#6]-[#6]-[#6]-[#7](-[#6])-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:15.22,8.8|
Show InChI InChI=1S/C16H29N5O4/c1-4-5-6-21(3)14(23)13(19-9(2)22)11-7-10(15(24)25)8-12(11)20-16(17)18/h10-13H,4-8H2,1-3H3,(H,19,22)(H,24,25)(H4,17,18,20)/t10?,11-,12-,13?/m0/s1
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n/an/a 2.40E+3n/an/an/an/a6.537



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4772
PNG
((3S,4S)-3-carbamimidamido-4-[(1S)-1-acetamido-2-(3...)
Show SMILES [#6]-[#6]-1-[#6]-[#6]-[#6]-[#7](-[#6]-1)-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:16.24,9.10|
Show InChI InChI=1S/C17H29N5O4/c1-9-4-3-5-22(8-9)15(24)14(20-10(2)23)12-6-11(16(25)26)7-13(12)21-17(18)19/h9,11-14H,3-8H2,1-2H3,(H,20,23)(H,25,26)(H4,18,19,21)/t9?,11?,12-,13-,14?/m0/s1
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n/an/a 2.55E+3n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza B virus (B/Lee/40))
BDBM4743
PNG
((3S,4S)-3-carbamimidamido-4-[(S)-acetamido(pentan-...)
Show SMILES [#6]-[#6]-[#6](-[#6]-[#6])-[#7]-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:15.22,8.8|
Show InChI InChI=1S/C16H29N5O4/c1-4-10(5-2)20-14(23)13(19-8(3)22)11-6-9(15(24)25)7-12(11)21-16(17)18/h9-13H,4-7H2,1-3H3,(H,19,22)(H,20,23)(H,24,25)(H4,17,18,21)/t9?,11-,12-,13?/m0/s1
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n/an/a 3.00E+3n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza B virus (B/Lee/40))
BDBM4758
PNG
((3S,4S)-3-carbamimidamido-4-[(S)-(diethylcarbamoyl...)
Show SMILES [#6]-[#6]-[#7](-[#6]-[#6])-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:14.21,7.7|
Show InChI InChI=1S/C15H27N5O4/c1-4-20(5-2)13(22)12(18-8(3)21)10-6-9(14(23)24)7-11(10)19-15(16)17/h9-12H,4-7H2,1-3H3,(H,18,21)(H,23,24)(H4,16,17,19)/t9?,10-,11-,12?/m0/s1
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n/an/a 3.00E+3n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza B virus (B/Lee/40))
BDBM4770
PNG
((3S,4S)-3-carbamimidamido-4-[(1S)-1-acetamido-2-(2...)
Show SMILES [#6]-[#6]-[#6]-1-[#6]-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:17.25,10.11|
Show InChI InChI=1S/C18H31N5O4/c1-3-12-6-4-5-7-23(12)16(25)15(21-10(2)24)13-8-11(17(26)27)9-14(13)22-18(19)20/h11-15H,3-9H2,1-2H3,(H,21,24)(H,26,27)(H4,19,20,22)/t11?,12?,13-,14-,15?/m0/s1
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n/an/a 3.10E+3n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza B virus (B/Lee/40))
BDBM4738
PNG
((3S,4S)-3-carbamimidamido-4-[(S)-acetamido(ethylca...)
Show SMILES [#6]-[#6]-[#7]-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:12.19,5.5|
Show InChI InChI=1S/C13H23N5O4/c1-3-16-11(20)10(17-6(2)19)8-4-7(12(21)22)5-9(8)18-13(14)15/h7-10H,3-5H2,1-2H3,(H,16,20)(H,17,19)(H,21,22)(H4,14,15,18)/t7?,8-,9-,10?/m0/s1
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n/an/a 3.10E+3n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4744
PNG
((3S,4S)-3-carbamimidamido-4-[(S)-acetamido(pentan-...)
Show SMILES [#6]-[#6]-[#6]-[#6](-[#6])-[#7]-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:15.22,8.8|
Show InChI InChI=1S/C16H29N5O4/c1-4-5-8(2)19-14(23)13(20-9(3)22)11-6-10(15(24)25)7-12(11)21-16(17)18/h8,10-13H,4-7H2,1-3H3,(H,19,23)(H,20,22)(H,24,25)(H4,17,18,21)/t8?,10?,11-,12-,13?/m0/s1
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n/an/a 3.20E+3n/an/an/an/a6.537



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4753
PNG
((3S,4S)-3-carbamimidamido-4-[(S)-acetamido[methyl(...)
Show SMILES [#6]-[#6](-[#6])-[#7](-[#6])-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:14.21,7.7|
Show InChI InChI=1S/C15H27N5O4/c1-7(2)20(4)13(22)12(18-8(3)21)10-5-9(14(23)24)6-11(10)19-15(16)17/h7,9-12H,5-6H2,1-4H3,(H,18,21)(H,23,24)(H4,16,17,19)/t9?,10-,11-,12?/m0/s1
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n/an/a 3.21E+3n/an/an/an/a6.537



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4774
PNG
((3S,4S)-3-carbamimidamido-4-[(1S)-2-(3,5-dimethylp...)
Show SMILES [#6]-[#6]-1-[#6]-[#6](-[#6])-[#6]-[#7](-[#6]-1)-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:17.25,10.11|
Show InChI InChI=1S/C18H31N5O4/c1-9-4-10(2)8-23(7-9)16(25)15(21-11(3)24)13-5-12(17(26)27)6-14(13)22-18(19)20/h9-10,12-15H,4-8H2,1-3H3,(H,21,24)(H,26,27)(H4,19,20,22)/t9?,10?,12?,13-,14-,15?/m0/s1
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n/an/a 3.50E+3n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza B virus (B/Lee/40))
BDBM4740
PNG
((3S,4S)-3-carbamimidamido-4-[(S)-acetamido(prop-2-...)
Show SMILES [#6]-[#6](=O)-[#7]-[#6](-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6]-[#6]=[#6] |r,w:7.14,4.3|
Show InChI InChI=1S/C14H23N5O4/c1-3-4-17-12(21)11(18-7(2)20)9-5-8(13(22)23)6-10(9)19-14(15)16/h3,8-11H,1,4-6H2,2H3,(H,17,21)(H,18,20)(H,22,23)(H4,15,16,19)/t8?,9-,10-,11?/m0/s1
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n/an/a 4.30E+3n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4750
PNG
((3S,4S)-3-carbamimidamido-4-[(S)-acetamido[(1-meth...)
Show SMILES [#6]-[#8]-[#6]-[#6](-[#6])-[#7]-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:15.22,8.8|
Show InChI InChI=1S/C15H27N5O5/c1-7(6-25-3)18-13(22)12(19-8(2)21)10-4-9(14(23)24)5-11(10)20-15(16)17/h7,9-12H,4-6H2,1-3H3,(H,18,22)(H,19,21)(H,23,24)(H4,16,17,20)/t7?,9?,10-,11-,12?/m0/s1
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n/an/a 4.40E+3n/an/an/an/a6.537



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza B virus (B/Lee/40))
BDBM4739
PNG
((3S,4S)-3-carbamimidamido-4-[(S)-acetamido(propan-...)
Show SMILES [#6]-[#6](-[#6])-[#7]-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:13.20,6.6|
Show InChI InChI=1S/C14H25N5O4/c1-6(2)17-12(21)11(18-7(3)20)9-4-8(13(22)23)5-10(9)19-14(15)16/h6,8-11H,4-5H2,1-3H3,(H,17,21)(H,18,20)(H,22,23)(H4,15,16,19)/t8?,9-,10-,11?/m0/s1
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n/an/a 4.60E+3n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza B virus (B/Lee/40))
BDBM4752
PNG
((3S,4S)-3-carbamimidamido-4-[(S)-acetamido[methyl(...)
Show SMILES [#6]-[#6]-[#6]-[#7](-[#6])-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:14.21,7.7|
Show InChI InChI=1S/C15H27N5O4/c1-4-5-20(3)13(22)12(18-8(2)21)10-6-9(14(23)24)7-11(10)19-15(16)17/h9-12H,4-7H2,1-3H3,(H,18,21)(H,23,24)(H4,16,17,19)/t9?,10-,11-,12?/m0/s1
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n/an/a 6.20E+3n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4748
PNG
((3S,4S)-3-carbamimidamido-4-[(S)-acetamido[(2-phen...)
Show SMILES [#6]-[#6](=O)-[#7]-[#6](-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6]-[#6]-c1ccccc1 |r,w:7.14,4.3|
Show InChI InChI=1S/C19H27N5O4/c1-11(25)23-16(17(26)22-8-7-12-5-3-2-4-6-12)14-9-13(18(27)28)10-15(14)24-19(20)21/h2-6,13-16H,7-10H2,1H3,(H,22,26)(H,23,25)(H,27,28)(H4,20,21,24)/t13?,14-,15-,16?/m0/s1
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n/an/a 6.40E+3n/an/an/an/a6.537



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza B virus (B/Lee/40))
BDBM4753
PNG
((3S,4S)-3-carbamimidamido-4-[(S)-acetamido[methyl(...)
Show SMILES [#6]-[#6](-[#6])-[#7](-[#6])-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:14.21,7.7|
Show InChI InChI=1S/C15H27N5O4/c1-7(2)20(4)13(22)12(18-8(3)21)10-5-9(14(23)24)6-11(10)19-15(16)17/h7,9-12H,5-6H2,1-4H3,(H,18,21)(H,23,24)(H4,16,17,19)/t9?,10-,11-,12?/m0/s1
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n/an/a 6.80E+3n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza B virus (B/Lee/40))
BDBM4767
PNG
((3S,4S)-3-carbamimidamido-4-[(1S)-1-acetamido-2-ox...)
Show SMILES [#6]-[#6](=O)-[#7]-[#6](-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O)-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6]-[#6]-1 |r,w:7.14,4.3|
Show InChI InChI=1S/C16H27N5O4/c1-9(22)19-13(14(23)21-5-3-2-4-6-21)11-7-10(15(24)25)8-12(11)20-16(17)18/h10-13H,2-8H2,1H3,(H,19,22)(H,24,25)(H4,17,18,20)/t10?,11-,12-,13?/m0/s1
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n/an/a 6.90E+3n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza B virus (B/Lee/40))
BDBM4759
PNG
((3S,4S)-3-carbamimidamido-4-[(S)-acetamido[ethyl(p...)
Show SMILES [#6]-[#6]-[#6]-[#7](-[#6]-[#6])-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:15.22,8.8|
Show InChI InChI=1S/C16H29N5O4/c1-4-6-21(5-2)14(23)13(19-9(3)22)11-7-10(15(24)25)8-12(11)20-16(17)18/h10-13H,4-8H2,1-3H3,(H,19,22)(H,24,25)(H4,17,18,20)/t10?,11-,12-,13?/m0/s1
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n/an/a 7.00E+3n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza B virus (B/Lee/40))
BDBM4775
PNG
((3S,4S)-3-carbamimidamido-4-[(1S)-1-acetamido-2-(m...)
Show SMILES [#6]-[#6](=O)-[#7]-[#6](-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O)-[#6](=O)-[#7]-1-[#6]-[#6]-[#8]-[#6]-[#6]-1 |r,w:7.14,4.3|
Show InChI InChI=1S/C15H25N5O5/c1-8(21)18-12(13(22)20-2-4-25-5-3-20)10-6-9(14(23)24)7-11(10)19-15(16)17/h9-12H,2-7H2,1H3,(H,18,21)(H,23,24)(H4,16,17,19)/t9?,10-,11-,12?/m0/s1
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n/an/a 7.80E+3n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4757
PNG
((3S,4S)-3-carbamimidamido-4-[(S)-acetamido[methyl(...)
Show SMILES [#6]-[#7](-[#6]-[#6]-c1ccccc1)-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:19.27,12.13|
Show InChI InChI=1S/C20H29N5O4/c1-12(26)23-17(15-10-14(19(28)29)11-16(15)24-20(21)22)18(27)25(2)9-8-13-6-4-3-5-7-13/h3-7,14-17H,8-11H2,1-2H3,(H,23,26)(H,28,29)(H4,21,22,24)/t14?,15-,16-,17?/m0/s1
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n/an/a 8.00E+3n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4773
PNG
((3S,4S)-3-carbamimidamido-4-[(1S)-1-acetamido-2-(4...)
Show SMILES [#6]-[#6]-1-[#6]-[#6]-[#7](-[#6]-[#6]-1)-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:16.24,9.10|
Show InChI InChI=1S/C17H29N5O4/c1-9-3-5-22(6-4-9)15(24)14(20-10(2)23)12-7-11(16(25)26)8-13(12)21-17(18)19/h9,11-14H,3-8H2,1-2H3,(H,20,23)(H,25,26)(H4,18,19,21)/t11?,12-,13-,14?/m0/s1
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n/an/a 8.20E+3n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4745
PNG
((3S,4S)-3-carbamimidamido-4-[(S)-acetamido[(4-meth...)
Show SMILES [#6]-[#6](-[#6])-[#6]-[#6](-[#6])-[#7]-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:16.23,9.9|
Show InChI InChI=1S/C17H31N5O4/c1-8(2)5-9(3)20-15(24)14(21-10(4)23)12-6-11(16(25)26)7-13(12)22-17(18)19/h8-9,11-14H,5-7H2,1-4H3,(H,20,24)(H,21,23)(H,25,26)(H4,18,19,22)/t9?,11?,12-,13-,14?/m0/s1
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n/an/a 8.40E+3n/an/an/an/a6.537



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza B virus (B/Lee/40))
BDBM4765
PNG
((3S,4S)-3-[(1S)-2-(azetidin-1-yl)-1-acetamido-2-ox...)
Show SMILES [#6]-[#6](=O)-[#7]-[#6](-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O)-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-1 |r,w:7.14,4.3|
Show InChI InChI=1S/C14H23N5O4/c1-7(20)17-11(12(21)19-3-2-4-19)9-5-8(13(22)23)6-10(9)18-14(15)16/h8-11H,2-6H2,1H3,(H,17,20)(H,22,23)(H4,15,16,18)/t8?,9-,10-,11?/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

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DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 8.40E+3n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (N9))
BDBM4746
PNG
((3S,4S)-3-carbamimidamido-4-[(S)-acetamido(hexan-2...)
Show SMILES [#6]-[#6]-[#6]-[#6]-[#6](-[#6])-[#7]-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:16.23,9.9|
Show InChI InChI=1S/C17H31N5O4/c1-4-5-6-9(2)20-15(24)14(21-10(3)23)12-7-11(16(25)26)8-13(12)22-17(18)19/h9,11-14H,4-8H2,1-3H3,(H,20,24)(H,21,23)(H,25,26)(H4,18,19,22)/t9?,11?,12-,13-,14?/m0/s1
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 8.70E+3n/an/an/an/a6.537



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza B virus (B/Lee/40))
BDBM4764
PNG
((3S,4S)-3-carbamimidamido-4-[(S)-(dipropylcarbamoy...)
Show SMILES [#6]-[#6]-[#6]-[#7](-[#6]-[#6]-[#6])-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H]-1-[#6]-[#6](-[#6]-[#6@@H]-1\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O |r,w:16.23,9.9|
Show InChI InChI=1S/C17H31N5O4/c1-4-6-22(7-5-2)15(24)14(20-10(3)23)12-8-11(16(25)26)9-13(12)21-17(18)19/h11-14H,4-9H2,1-3H3,(H,20,23)(H,25,26)(H4,18,19,21)/t11?,12-,13-,14?/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 9.20E+3n/an/an/an/an/an/a



BioCryst Pharmaceuticals, Inc.



Assay Description
A standard fluorimetric assay was used to measure influenza virus neuraminidase activity. The substrate 2 -(4-methylumbelliferyl)-alpha-D-acetylneura...


J Med Chem 47: 1919-29 (2004)


Article DOI: 10.1021/jm0303406
BindingDB Entry DOI: 10.7270/Q2NP22NH
More data for this
Ligand-Target Pair
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