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PubChem AID 588502

Compile Data Set for Download or QSAR

Found 464 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
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM49192
PNG
((3-Cyano-7-methoxy-quinolin-2-ylsulfanyl)-acetic a...)
Show SMILES COC(=O)CSc1nc2cc(OC)ccc2cc1C#N
Show InChI InChI=1S/C14H12N2O3S/c1-18-11-4-3-9-5-10(7-15)14(16-12(9)6-11)20-8-13(17)19-2/h3-6H,8H2,1-2H3
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n/an/an/an/a 4.84E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM32018
PNG
(1,8-DIACETOXY-3-CARBOXYANTHRAQUINONE | 4,5-diaceto...)
Show SMILES CC(=O)Oc1cccc2C(=O)c3cc(cc(OC(C)=O)c3C(=O)c12)C(O)=O
Show InChI InChI=1S/C19H12O8/c1-8(20)26-13-5-3-4-11-15(13)18(23)16-12(17(11)22)6-10(19(24)25)7-14(16)27-9(2)21/h3-7H,1-2H3,(H,24,25)
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n/an/an/an/a>9.90E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM44436
PNG
(3-phenyl-1-propyl-pyrazolo[4,3-b]quinoxaline | 3-p...)
Show SMILES CCCn1nc(-c2ccccc2)c2nc3ccccc3nc12
Show InChI InChI=1S/C18H16N4/c1-2-12-22-18-17(16(21-22)13-8-4-3-5-9-13)19-14-10-6-7-11-15(14)20-18/h3-11H,2,12H2,1H3
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n/an/an/an/a 6.17E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM83479
PNG
(4-(2,6-dimethyl-4-pyranylidene)-3-ethyl-2-sulfanyl...)
Show SMILES CCN1C(=S)SC(=O)C1=C1C=C(C)OC(C)=C1
Show InChI InChI=1S/C12H13NO2S2/c1-4-13-10(11(14)17-12(13)16)9-5-7(2)15-8(3)6-9/h5-6H,4H2,1-3H3
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM83498
PNG
(2-(2,6-dimethylphenyl)-3-keto-N-(o-tolyl)-1,4-dihy...)
Show SMILES Cc1ccccc1NC(=O)C1N(C(=O)C[n+]2ccccc12)c1c(C)cccc1C
Show InChI InChI=1S/C24H23N3O2/c1-16-9-4-5-12-19(16)25-24(29)23-20-13-6-7-14-26(20)15-21(28)27(23)22-17(2)10-8-11-18(22)3/h4-14,23H,15H2,1-3H3/p+1
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n/an/an/an/a>9.90E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM41489
PNG
((4Z)-2-(4-fluorophenyl)-4-[(2-methyl-1H-indol-3-yl...)
Show SMILES Cc1[nH]c2ccccc2c1\C=C1/N=C(OC1=O)c1ccc(F)cc1
Show InChI InChI=1S/C19H13FN2O2/c1-11-15(14-4-2-3-5-16(14)21-11)10-17-19(23)24-18(22-17)12-6-8-13(20)9-7-12/h2-10,21H,1H3/b17-10-
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n/an/an/an/a 5.59E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM52261
PNG
((4Z)-2-[(E)-2-(3-nitrophenyl)ethenyl]-4-(phenylaza...)
Show SMILES Oc1oc(\C=C\c2cccc(c2)[N+]([O-])=O)nc1\C=N\c1ccccc1
Show InChI InChI=1S/C18H13N3O4/c22-18-16(12-19-14-6-2-1-3-7-14)20-17(25-18)10-9-13-5-4-8-15(11-13)21(23)24/h1-12,22H/b10-9+,19-12+
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n/an/an/an/a 1.92E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM50905
PNG
((9-Methoxy-indolo[2,3-b]quinoxalin-6-yl)-acetic ac...)
Show SMILES CCCCOC(=O)Cn1c2ccc(OC)cc2c2nc3ccccc3nc12
Show InChI InChI=1S/C21H21N3O3/c1-3-4-11-27-19(25)13-24-18-10-9-14(26-2)12-15(18)20-21(24)23-17-8-6-5-7-16(17)22-20/h5-10,12H,3-4,11,13H2,1-2H3
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n/an/an/an/a 2.47E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM33099
PNG
(2-[[(5E)-5-(4-acetoxybenzylidene)-4-keto-2-thiazol...)
Show SMILES CCOC(=O)CSC1=NC(=O)\C(S1)=C/c1ccc(OC(C)=O)cc1
Show InChI InChI=1S/C16H15NO5S2/c1-3-21-14(19)9-23-16-17-15(20)13(24-16)8-11-4-6-12(7-5-11)22-10(2)18/h4-8H,3,9H2,1-2H3/b13-8+
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM83521
PNG
(1,3-benzodioxole-5-carboxylic acid [2-methoxy-4-[[...)
Show SMILES COc1cc(C=NNC(=O)c2cccnc2)ccc1OC(=O)c1ccc2OCOc2c1
Show InChI InChI=1S/C22H17N3O6/c1-28-19-9-14(11-24-25-21(26)16-3-2-8-23-12-16)4-6-18(19)31-22(27)15-5-7-17-20(10-15)30-13-29-17/h2-12H,13H2,1H3,(H,25,26)
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM52390
PNG
(6-keto-N,1-diphenyl-4-(trifluoromethyl)pyridazine-...)
Show SMILES FC(F)(F)c1cc(=O)n(nc1C(=O)Nc1ccccc1)-c1ccccc1
Show InChI InChI=1S/C18H12F3N3O2/c19-18(20,21)14-11-15(25)24(13-9-5-2-6-10-13)23-16(14)17(26)22-12-7-3-1-4-8-12/h1-11H,(H,22,26)
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM47577
PNG
((5Z)-3-ethyl-2-sulfanylidene-5-[(1,2,5-trimethyl-3...)
Show SMILES CCN1C(=S)S\C(=C/c2cc(C)n(C)c2C)C1=O
Show InChI InChI=1S/C13H16N2OS2/c1-5-15-12(16)11(18-13(15)17)7-10-6-8(2)14(4)9(10)3/h6-7H,5H2,1-4H3/b11-7-
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM83529
PNG
((4E)-4-[(1-acetyl-3-indolyl)methylidene]-2-phenyl-...)
Show SMILES CC(=O)n1cc(\C=C2\N=C(OC2=O)c2ccccc2)c2ccccc12
Show InChI InChI=1S/C20H14N2O3/c1-13(23)22-12-15(16-9-5-6-10-18(16)22)11-17-20(24)25-19(21-17)14-7-3-2-4-8-14/h2-12H,1H3/b17-11+
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n/an/an/an/a>9.90E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM83530
PNG
(2-(2,4-Dimethoxy-phenylamino)-6-methyl-quinoline-3...)
Show SMILES COc1ccc(Nc2nc3ccc(C)cc3cc2C#N)c(OC)c1
Show InChI InChI=1S/C19H17N3O2/c1-12-4-6-16-13(8-12)9-14(11-20)19(21-16)22-17-7-5-15(23-2)10-18(17)24-3/h4-10H,1-3H3,(H,21,22)
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n/an/an/an/a 1.42E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM83540
PNG
(5-[(3-Methyl-5-oxo-1-phenyl-1,5-dihydro-pyrazol-4-...)
Show SMILES Cc1[nH]n(-c2ccccc2)c(=O)c1C=Nc1ccc2[nH]c(=O)[nH]c2c1
Show InChI InChI=1S/C18H15N5O2/c1-11-14(17(24)23(22-11)13-5-3-2-4-6-13)10-19-12-7-8-15-16(9-12)21-18(25)20-15/h2-10,22H,1H3,(H2,20,21,25)/b19-10+
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM83542
PNG
((4Z)-4-{[(2-hydroxy-1H-benzimidazol-6-yl)amino]met...)
Show SMILES Cc1[nH]n(-c2cccc(C)c2)c(=O)c1C=Nc1ccc2[nH]c(=O)[nH]c2c1
Show InChI InChI=1S/C19H17N5O2/c1-11-4-3-5-14(8-11)24-18(25)15(12(2)23-24)10-20-13-6-7-16-17(9-13)22-19(26)21-16/h3-10,23H,1-2H3,(H2,21,22,26)/b20-10+
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n/an/an/an/a 6.52E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM83547
PNG
((E)-2-(4-cyclopropyl-1,3-thiazol-2-yl)-3-(4-nitrop...)
Show SMILES [O-][N+](=O)c1ccc(\C=C(/C#N)c2nc(cs2)C2CC2)cc1
Show InChI InChI=1S/C15H11N3O2S/c16-8-12(15-17-14(9-21-15)11-3-4-11)7-10-1-5-13(6-2-10)18(19)20/h1-2,5-7,9,11H,3-4H2/b12-7+
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM52459
PNG
(2-[3-(9-Methoxy-indolo[2,3-b]quinoxalin-6-yl)-prop...)
Show SMILES COc1ccc2n(CCCN3C(=O)c4ccccc4C3=O)c3nc4ccccc4nc3c2c1
Show InChI InChI=1S/C26H20N4O3/c1-33-16-11-12-22-19(15-16)23-24(28-21-10-5-4-9-20(21)27-23)29(22)13-6-14-30-25(31)17-7-2-3-8-18(17)26(30)32/h2-5,7-12,15H,6,13-14H2,1H3
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n/an/an/an/a>9.90E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM60553
PNG
(MLS000390001 | N-[(5-morpholino-2-thienyl)methylen...)
Show SMILES CC(C)(C)OC(=O)NN=Cc1ccc(s1)N1CCOCC1
Show InChI InChI=1S/C14H21N3O3S/c1-14(2,3)20-13(18)16-15-10-11-4-5-12(21-11)17-6-8-19-9-7-17/h4-5,10H,6-9H2,1-3H3,(H,16,18)
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n/an/an/an/a 4.69E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM49695
PNG
(2-(acetonylthio)-6-methoxy-quinoline-3-carbonitril...)
Show SMILES COc1ccc2nc(SCC(C)=O)c(cc2c1)C#N
Show InChI InChI=1S/C14H12N2O2S/c1-9(17)8-19-14-11(7-15)5-10-6-12(18-2)3-4-13(10)16-14/h3-6H,8H2,1-2H3
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n/an/an/an/a 1.65E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM83586
PNG
((4Z)-2-(methylthio)-4-[(5-methyl-2-thiophenyl)meth...)
Show SMILES CSC1=N\C(=C/c2ccc(C)s2)C(=O)S1
Show InChI InChI=1S/C10H9NOS3/c1-6-3-4-7(14-6)5-8-9(12)15-10(11-8)13-2/h3-5H,1-2H3/b8-5-
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n/an/an/an/a 7.20E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM63376
PNG
(2-(2,3-dihydro-1,4-benzodioxin-3-ylcarbonylamino)-...)
Show SMILES NC(=O)c1c(NC(=O)C2COc3ccccc3O2)sc2CN(Cc3ccccc3)CCc12
Show InChI InChI=1S/C24H23N3O4S/c25-22(28)21-16-10-11-27(12-15-6-2-1-3-7-15)13-20(16)32-24(21)26-23(29)19-14-30-17-8-4-5-9-18(17)31-19/h1-9,19H,10-14H2,(H2,25,28)(H,26,29)
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n/an/an/an/a 8.51E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM61621
PNG
((5Z)-3-(2-methoxyethyl)-5-(4-pyrrolidinobenzyliden...)
Show SMILES COCCN1C(=S)S\C(=C/c2ccc(cc2)N2CCCC2)C1=O
Show InChI InChI=1S/C17H20N2O2S2/c1-21-11-10-19-16(20)15(23-17(19)22)12-13-4-6-14(7-5-13)18-8-2-3-9-18/h4-7,12H,2-3,8-11H2,1H3/b15-12-
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n/an/an/an/a>9.90E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM83597
PNG
((5Z)-3-(2-methoxyphenyl)-5-[(1,2,5-trimethyl-3-pyr...)
Show SMILES COc1ccccc1N1C(=O)S\C(=C/c2cc(C)n(C)c2C)C1=O
Show InChI InChI=1S/C18H18N2O3S/c1-11-9-13(12(2)19(11)3)10-16-17(21)20(18(22)24-16)14-7-5-6-8-15(14)23-4/h5-10H,1-4H3/b16-10-
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n/an/an/an/a 3.06E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM83623
PNG
((4Z)-1-isobutyl-5-keto-2-methyl-4-(2-thenylidene)-...)
Show SMILES CCOC(=O)C1=C(C)N(CC(C)C)C(=O)\C1=C/c1cccs1
Show InChI InChI=1S/C17H21NO3S/c1-5-21-17(20)15-12(4)18(10-11(2)3)16(19)14(15)9-13-7-6-8-22-13/h6-9,11H,5,10H2,1-4H3/b14-9-
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n/an/an/an/a>9.90E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM83624
PNG
(3-(3-Hydroxy-propyl)-4-imino-10-phenyl-3,10-dihydr...)
Show SMILES OCCCn1cnc2Oc3cc(O)ccc3C(c3ccccc3)c2c1=N
Show InChI InChI=1S/C20H19N3O3/c21-19-18-17(13-5-2-1-3-6-13)15-8-7-14(25)11-16(15)26-20(18)22-12-23(19)9-4-10-24/h1-3,5-8,11-12,17,21,24-25H,4,9-10H2
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM83625
PNG
(2-(phenacylthio)-6-(3-pyridinyl)-3-pyridinecarboni...)
Show SMILES O=C(CSc1nc(ccc1C#N)-c1cccnc1)c1ccccc1
Show InChI InChI=1S/C19H13N3OS/c20-11-15-8-9-17(16-7-4-10-21-12-16)22-19(15)24-13-18(23)14-5-2-1-3-6-14/h1-10,12H,13H2
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n/an/an/an/a 3.59E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM83635
PNG
(3-Methyl-2-[2-(2-nitro-phenyl)-vinyl]-3H-quinazoli...)
Show SMILES Cn1c(\C=C\c2ccccc2[N+]([O-])=O)nc2ccccc2c1=O
Show InChI InChI=1S/C17H13N3O3/c1-19-16(18-14-8-4-3-7-13(14)17(19)21)11-10-12-6-2-5-9-15(12)20(22)23/h2-11H,1H3/b11-10+
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n/an/an/an/a>9.90E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM53059
PNG
(2-(7-Nitro-benzo[1,2,5]oxadiazol-4-ylamino)-phenol...)
Show SMILES [O-]c1ccccc1\N=c1/ccc([N+]([O-])=O)c2[nH]o[nH+]c12
Show InChI InChI=1S/C12H8N4O4/c17-10-4-2-1-3-7(10)13-8-5-6-9(16(18)19)12-11(8)14-20-15-12/h1-6,15,17H/b13-8+
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n/an/an/an/a>9.90E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM83641
PNG
((6E)-6-[4-(3-methoxyanilino)-1H-quinazolin-2-ylide...)
Show SMILES COc1cccc(Nc2nc(nc3ccccc23)-c2ccccc2O)c1
Show InChI InChI=1S/C21H17N3O2/c1-26-15-8-6-7-14(13-15)22-20-16-9-2-4-11-18(16)23-21(24-20)17-10-3-5-12-19(17)25/h2-13,25H,1H3,(H,22,23,24)
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n/an/an/an/a 4.07E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM53161
PNG
((3E)-1H-indole-2,3-dione 3-[(3-chlorophenyl)hydraz...)
Show SMILES Clc1cccc(NNC2=c3ccccc3=NC2=O)c1
Show InChI InChI=1S/C14H10ClN3O/c15-9-4-3-5-10(8-9)17-18-13-11-6-1-2-7-12(11)16-14(13)19/h1-8,17H,(H,16,18,19)
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n/an/an/an/a>9.90E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM53222
PNG
((5E)-1-(4-ethoxyphenyl)-5-(1H-indol-3-ylmethylene)...)
Show SMILES CCOc1ccc(cc1)N1C(=O)NC(=O)C(=Cc2c[nH]c3ccccc23)C1=O
Show InChI InChI=1S/C21H17N3O4/c1-2-28-15-9-7-14(8-10-15)24-20(26)17(19(25)23-21(24)27)11-13-12-22-18-6-4-3-5-16(13)18/h3-12,22H,2H2,1H3,(H,23,25,27)
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n/an/an/an/a 1.63E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM83655
PNG
((E)-2-cyano-3-[4-(methylamino)-3-nitro-phenyl]-N-(...)
Show SMILES CNc1ccc(\C=C(/C#N)C(=O)Nc2ccccn2)cc1[N+]([O-])=O
Show InChI InChI=1S/C16H13N5O3/c1-18-13-6-5-11(9-14(13)21(23)24)8-12(10-17)16(22)20-15-4-2-3-7-19-15/h2-9,18H,1H3,(H,19,20,22)/b12-8+
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n/an/an/an/a 3.92E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM83660
PNG
((2-methoxy-5-methyl-phenyl)-[(5E)-5-(5-methoxy-3-n...)
Show SMILES COc1ccc(C)cc1Nc1[nH+][n+](c(s1)-[c-]1cc(cc(OC)c1=O)[N+]([O-])=O)-c1ccccc1
Show InChI InChI=1S/C23H21N4O5S/c1-14-9-10-19(31-2)18(11-14)24-23-25-26(15-7-5-4-6-8-15)22(33-23)17-12-16(27(29)30)13-20(32-3)21(17)28/h4-13,24-25H,1-3H3/q+1
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n/an/an/an/a 5.84E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM83663
PNG
(4-[[(2-keto-1,3,3-trimethyl-indolin-5-yl)sulfonyla...)
Show SMILES CCC(C)NC(=O)c1ccc(CNS(=O)(=O)c2ccc3N(C)C(=O)C(C)(C)c3c2)cc1
Show InChI InChI=1S/C23H29N3O4S/c1-6-15(2)25-21(27)17-9-7-16(8-10-17)14-24-31(29,30)18-11-12-20-19(13-18)23(3,4)22(28)26(20)5/h7-13,15,24H,6,14H2,1-5H3,(H,25,27)
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM83666
PNG
(4-methylbenzoic acid [5-amino-1-(4-fluorophenyl)su...)
Show SMILES Cc1ccc(cc1)C(=O)Oc1cc(N)n(n1)S(=O)(=O)c1ccc(F)cc1
Show InChI InChI=1S/C17H14FN3O4S/c1-11-2-4-12(5-3-11)17(22)25-16-10-15(19)21(20-16)26(23,24)14-8-6-13(18)7-9-14/h2-10H,19H2,1H3
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n/an/an/an/a 4.10E+3n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM83677
PNG
(4-methoxy-N-[(6-methyl-4-oxidanylidene-chromen-3-y...)
Show SMILES COc1ccc(cc1)C(=O)NN=Cc1coc2ccc(C)cc2c1=O
Show InChI InChI=1S/C19H16N2O4/c1-12-3-8-17-16(9-12)18(22)14(11-25-17)10-20-21-19(23)13-4-6-15(24-2)7-5-13/h3-11H,1-2H3,(H,21,23)
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM83692
PNG
(MLS002425460 | SMR001371386 | cid_44142831)
Show SMILES Cc1ccc2OC[C@H]3[C@@H](N4C(=O)CN(Cc5ccc(F)cc5)C(=O)[C@@]4(C)[C@H]3c3ccccc3)c2c1
Show InChI InChI=1S/C29H27FN2O3/c1-18-8-13-24-22(14-18)27-23(17-35-24)26(20-6-4-3-5-7-20)29(2)28(34)31(16-25(33)32(27)29)15-19-9-11-21(30)12-10-19/h3-14,23,26-27H,15-17H2,1-2H3/t23-,26+,27+,29-/m1/s1
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n/an/an/an/a 6.39E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM83701
PNG
((Z)-2-cyano-N-(2-fluorophenyl)-3-[(3E)-2-(4-morpho...)
Show SMILES [O-][N+](=O)c1cccc(\C=C2/CCC(\C=C(\C#N)C(=O)Nc3ccccc3F)=C2N2CCOCC2)c1
Show InChI InChI=1S/C26H23FN4O4/c27-23-6-1-2-7-24(23)29-26(32)21(17-28)16-20-9-8-19(25(20)30-10-12-35-13-11-30)14-18-4-3-5-22(15-18)31(33)34/h1-7,14-16H,8-13H2,(H,29,32)/b19-14+,21-16-
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM83720
PNG
(6-(2-naphthalenylsulfonyl)quinazoline-2,4-diamine ...)
Show SMILES Nc1nc(N)c2cc(ccc2n1)S(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C18H14N4O2S/c19-17-15-10-14(7-8-16(15)21-18(20)22-17)25(23,24)13-6-5-11-3-1-2-4-12(11)9-13/h1-10H,(H4,19,20,21,22)
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n/an/an/an/a>9.90E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM83722
PNG
(3,7-dimethyl-7,8-bis(oxidanyl)-6-oxidanylidene-8H-...)
Show SMILES CC1=CC2=C(C=O)C(=O)C(C)(O)C(O)C2=CO1
Show InChI InChI=1S/C12H12O5/c1-6-3-7-8(4-13)10(14)12(2,16)11(15)9(7)5-17-6/h3-5,11,15-16H,1-2H3
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM81278
PNG
(4-(4-methylphenyl)sulfinyl-7-nitro-2,1,3-benzoxadi...)
Show SMILES Cc1ccc(cc1)S(=O)c1ccc([N+]([O-])=O)c2nonc12
Show InChI InChI=1S/C13H9N3O4S/c1-8-2-4-9(5-3-8)21(19)11-7-6-10(16(17)18)12-13(11)15-20-14-12/h2-7H,1H3
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM31009
PNG
(1-[3-[1-cyano-2-(cyclohexylamino)-2-keto-ethyl]qui...)
Show SMILES NC(=O)C1CCN(CC1)c1nc2ccccc2nc1C(C#N)C(=O)NC1CCCCC1
Show InChI InChI=1S/C23H28N6O2/c24-14-17(23(31)26-16-6-2-1-3-7-16)20-22(28-19-9-5-4-8-18(19)27-20)29-12-10-15(11-13-29)21(25)30/h4-5,8-9,15-17H,1-3,6-7,10-13H2,(H2,25,30)(H,26,31)
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n/an/an/an/a 3.61E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM83474
PNG
((6E)-6-[4-(2-furanylmethylamino)-1H-quinazolin-2-y...)
Show SMILES Oc1ccccc1-c1nc(NCc2ccco2)c2ccccc2n1
Show InChI InChI=1S/C19H15N3O2/c23-17-10-4-2-8-15(17)19-21-16-9-3-1-7-14(16)18(22-19)20-12-13-6-5-11-24-13/h1-11,23H,12H2,(H,20,21,22)
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM83475
PNG
(2-(9-methoxy-6-indolo[3,2-b]quinoxalinyl)acetic ac...)
Show SMILES COC(=O)Cn1c2ccc(OC)cc2c2nc3ccccc3nc12
Show InChI InChI=1S/C18H15N3O3/c1-23-11-7-8-15-12(9-11)17-18(21(15)10-16(22)24-2)20-14-6-4-3-5-13(14)19-17/h3-9H,10H2,1-2H3
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM52143
PNG
(2-cyano-N-(phenylmethyl)-2-(3-pyrrolidin-1-ylquino...)
Show SMILES O=C(NCc1ccccc1)C(C#N)c1nc2ccccc2nc1N1CCCC1
Show InChI InChI=1S/C22H21N5O/c23-14-17(22(28)24-15-16-8-2-1-3-9-16)20-21(27-12-6-7-13-27)26-19-11-5-4-10-18(19)25-20/h1-5,8-11,17H,6-7,12-13,15H2,(H,24,28)
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM83487
PNG
(2-[[2-keto-2-(2-thienyl)ethyl]thio]-4,6-dimethyl-n...)
Show SMILES Cc1cc(C)c(C#N)c(SCC(=O)c2cccs2)n1
Show InChI InChI=1S/C14H12N2OS2/c1-9-6-10(2)16-14(11(9)7-15)19-8-12(17)13-4-3-5-18-13/h3-6H,8H2,1-2H3
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM83490
PNG
((4Z)-2-(allylthio)-4-[(7-methoxy-1,3-benzodioxol-5...)
Show SMILES COc1cc(\C=C2/N=C(SCC=C)SC2=O)cc2OCOc12
Show InChI InChI=1S/C15H13NO4S2/c1-3-4-21-15-16-10(14(17)22-15)5-9-6-11(18-2)13-12(7-9)19-8-20-13/h3,5-7H,1,4,8H2,2H3/b10-5-
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n/an/an/an/a 6.45E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM52262
PNG
(4-[(4-hydroxyanilino)methyl]-1(2H)-phthalazinone |...)
Show SMILES Oc1ccc(NCc2n[nH]c(=O)c3ccccc23)cc1
Show InChI InChI=1S/C15H13N3O2/c19-11-7-5-10(6-8-11)16-9-14-12-3-1-2-4-13(12)15(20)18-17-14/h1-8,16,19H,9H2,(H,18,20)
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM83506
PNG
((5Z)-5-[[2-(3-isopropoxypropylamino)-4-keto-9-meth...)
Show SMILES CCCN1C(=S)S\C(=C/c2c(NCCCOC(C)C)nc3c(C)cccn3c2=O)C1=O
Show InChI InChI=1S/C22H28N4O3S2/c1-5-10-26-21(28)17(31-22(26)30)13-16-18(23-9-7-12-29-14(2)3)24-19-15(4)8-6-11-25(19)20(16)27/h6,8,11,13-14,23H,5,7,9-10,12H2,1-4H3/b17-13-
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n/an/an/an/a 3.42E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
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* indicates data uncertainty>20%