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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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM62545
PNG
(3-amino-8-methyl-2-thieno[2,3-b]quinolinecarbonitr...)
Show SMILES Cc1cccc2cc3c(N)c(sc3nc12)C#N
Show InChI InChI=1S/C13H9N3S/c1-7-3-2-4-8-5-9-11(15)10(6-14)17-13(9)16-12(7)8/h2-5H,15H2,1H3
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n/an/an/an/a 4.31E+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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM30718
PNG
(7-(diethylamino)-2-keto-N-(2-pyridyl)chromene-3-ca...)
Show SMILES CCN(CC)c1ccc2cc(C(=O)Nc3ccccn3)c(=O)oc2c1
Show InChI InChI=1S/C19H19N3O3/c1-3-22(4-2)14-9-8-13-11-15(19(24)25-16(13)12-14)18(23)21-17-7-5-6-10-20-17/h5-12H,3-4H2,1-2H3,(H,20,21,23)
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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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM52119
PNG
(1-[3-amino-6-(2-thienyl)-4-(trifluoromethyl)thieno...)
Show SMILES CC(=O)c1sc2nc(cc(c2c1N)C(F)(F)F)-c1cccs1
Show InChI InChI=1S/C14H9F3N2OS2/c1-6(20)12-11(18)10-7(14(15,16)17)5-8(19-13(10)22-12)9-3-2-4-21-9/h2-5H,18H2,1H3
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n/an/an/an/a 2.23E+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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM83473
PNG
(4-[5-(3-methoxyphenyl)-1,7-dihydro-[1,2,3,4]tetraz...)
Show SMILES COc1cccc(c1)C1=Nc2nnnn2C(C1)c1ccc(cc1)N(C)C |t:9|
Show InChI InChI=1S/C19H20N6O/c1-24(2)15-9-7-13(8-10-15)18-12-17(20-19-21-22-23-25(18)19)14-5-4-6-16(11-14)26-3/h4-11,18H,12H2,1-3H3
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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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM50789
PNG
(2-(9-methoxy-6-indolo[3,2-b]quinoxalinyl)acetic ac...)
Show SMILES CCOC(=O)Cn1c2ccc(OC)cc2c2nc3ccccc3nc12
Show InChI InChI=1S/C19H17N3O3/c1-3-25-17(23)11-22-16-9-8-12(24-2)10-13(16)18-19(22)21-15-7-5-4-6-14(15)20-18/h4-10H,3,11H2,1-2H3
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n/an/an/an/a 5.07E+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
Endoribonuclease toxin MazF


(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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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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM83476
PNG
((2-oxidanylidene-1H-quinolin-3-yl)methyl 3-methylb...)
Show SMILES Cc1cccc(c1)C(=O)OCc1cc2ccccc2[nH]c1=O
Show InChI InChI=1S/C18H15NO3/c1-12-5-4-7-14(9-12)18(21)22-11-15-10-13-6-2-3-8-16(13)19-17(15)20/h2-10H,11H2,1H3,(H,19,20)
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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
Endoribonuclease toxin MazF


(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
Endoribonuclease toxin MazF


(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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM83481
PNG
(2-[1-(3,4-dimethylphenyl)-4-keto-pyrazolo[3,4-d]py...)
Show SMILES CCOc1ccccc1NC(=O)Cn1cnc2n(ncc2c1=O)-c1ccc(C)c(C)c1
Show InChI InChI=1S/C23H23N5O3/c1-4-31-20-8-6-5-7-19(20)26-21(29)13-27-14-24-22-18(23(27)30)12-25-28(22)17-10-9-15(2)16(3)11-17/h5-12,14H,4,13H2,1-3H3,(H,26,29)
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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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM52227
PNG
(3-Ethyl-2-[2-(5-nitro-furan-2-yl)-vinyl]-3H-quinaz...)
Show SMILES CCn1c(\C=C\c2ccc(o2)[N+]([O-])=O)nc2ccccc2c1=O
Show InChI InChI=1S/C16H13N3O4/c1-2-18-14(9-7-11-8-10-15(23-11)19(21)22)17-13-6-4-3-5-12(13)16(18)20/h3-10H,2H2,1H3/b9-7+
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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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM83492
PNG
((3-Cyano-6-methyl-quinolin-2-ylsulfanyl)-acetic ac...)
Show SMILES CCOC(=O)CSc1nc2ccc(C)cc2cc1C#N
Show InChI InChI=1S/C15H14N2O2S/c1-3-19-14(18)9-20-15-12(8-16)7-11-6-10(2)4-5-13(11)17-15/h4-7H,3,9H2,1-2H3
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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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM66106
PNG
(7-(diethylamino)-3-(5-phenyl-1,3,4-oxadiazol-2-yl)...)
Show SMILES CCN(CC)c1ccc2cc(-c3nnc(o3)-c3ccccc3)c(=O)oc2c1
Show InChI InChI=1S/C21H19N3O3/c1-3-24(4-2)16-11-10-15-12-17(21(25)26-18(15)13-16)20-23-22-19(27-20)14-8-6-5-7-9-14/h5-13H,3-4H2,1-2H3
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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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM61015
PNG
(3-(4-fluorophenyl)-7,8-dimethoxy-5-(phenylmethyl)p...)
Show SMILES COc1cc2n(Cc3ccccc3)cc3c(nnc3c2cc1OC)-c1ccc(F)cc1
Show InChI InChI=1S/C25H20FN3O2/c1-30-22-12-19-21(13-23(22)31-2)29(14-16-6-4-3-5-7-16)15-20-24(27-28-25(19)20)17-8-10-18(26)11-9-17/h3-13,15H,14H2,1-2H3
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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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM52270
PNG
((5E)-3-ethyl-5-(1-methyl-2-quinolinylidene)-2-sulf...)
Show SMILES CCN1C(=S)O\C(C1=O)=C1/C=Cc2ccccc2N1C |c:11|
Show InChI InChI=1S/C15H14N2O2S/c1-3-17-14(18)13(19-15(17)20)12-9-8-10-6-4-5-7-11(10)16(12)2/h4-9H,3H2,1-2H3/b13-12+
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Burnham Center for Chemical Genomics

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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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM49444
PNG
(3-(4-ethylphenyl)-1-(methylsulfonyl)-5-(2-thienyl)...)
Show SMILES CCc1ccc(cc1)C1=NN(C(C1)c1cccs1)S(C)(=O)=O |t:9|
Show InChI InChI=1S/C16H18N2O2S2/c1-3-12-6-8-13(9-7-12)14-11-15(16-5-4-10-21-16)18(17-14)22(2,19)20/h4-10,15H,3,11H2,1-2H3
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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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM83505
PNG
(2-(2-phenylvinyl)-6,7-dihydro-4H,5H-cyclopenta[4,5...)
Show SMILES O=c1oc(\C=C\c2ccccc2)nc2sc3CCCc3c12
Show InChI InChI=1S/C17H13NO2S/c19-17-15-12-7-4-8-13(12)21-16(15)18-14(20-17)10-9-11-5-2-1-3-6-11/h1-3,5-6,9-10H,4,7-8H2/b10-9+
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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
Endoribonuclease toxin MazF


(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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM83507
PNG
(2-((E)-2-Furan-2-yl-vinyl)-6,7-dihydro-5H-cyclopen...)
Show SMILES O=c1oc(\C=C\c2ccco2)nc2sc3CCCc3c12
Show InChI InChI=1S/C15H11NO3S/c17-15-13-10-4-1-5-11(10)20-14(13)16-12(19-15)7-6-9-3-2-8-18-9/h2-3,6-8H,1,4-5H2/b7-6+
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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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM83508
PNG
(2-benzal-5-(3,4-dimethoxyphenyl)-3-keto-7-methyl-5...)
Show SMILES CCOC(=O)C1=C(C)N=c2sc(=Cc3ccccc3)c(=O)n2C1c1ccc(OC)c(OC)c1 |c:5,t:8|
Show InChI InChI=1S/C25H24N2O5S/c1-5-32-24(29)21-15(2)26-25-27(22(21)17-11-12-18(30-3)19(14-17)31-4)23(28)20(33-25)13-16-9-7-6-8-10-16/h6-14,22H,5H2,1-4H3
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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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM83304
PNG
(4-Amino-furazan-3-carboxylic acid (2-{[2-(2-fluoro...)
Show SMILES Nc1nonc1C(=O)NCCNCc1c(OCc2ccccc2F)ccc2ccccc12
Show InChI InChI=1S/C23H22FN5O3/c24-19-8-4-2-6-16(19)14-31-20-10-9-15-5-1-3-7-17(15)18(20)13-26-11-12-27-23(30)21-22(25)29-32-28-21/h1-10,26H,11-14H2,(H2,25,29)(H,27,30)
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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
Endoribonuclease toxin MazF


(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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM77499
PNG
(2-(2-Methoxy-phenylamino)-8-methyl-quinoline-3-car...)
Show SMILES COc1ccccc1Nc1nc2c(C)cccc2cc1C#N
Show InChI InChI=1S/C18H15N3O/c1-12-6-5-7-13-10-14(11-19)18(21-17(12)13)20-15-8-3-4-9-16(15)22-2/h3-10H,1-2H3,(H,20,21)
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n/an/an/an/a 7.39E+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
Endoribonuclease toxin MazF


(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 |c:8|
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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM83532
PNG
(2-(3-chloranylphenoxy)-N-[(2-chloranylquinolin-3-y...)
Show SMILES Clc1cccc(OCC(=O)NN=Cc2cc3ccccc3nc2Cl)c1
Show InChI InChI=1S/C18H13Cl2N3O2/c19-14-5-3-6-15(9-14)25-11-17(24)23-21-10-13-8-12-4-1-2-7-16(12)22-18(13)20/h1-10H,11H2,(H,23,24)
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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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM50975
PNG
(6,11-diketonaphth[2,3-b]indolizine-12-carboxylic a...)
Show SMILES CC(C)OC(=O)c1c2c(C(=O)c3ccccc3C2=O)n2ccccc12
Show InChI InChI=1S/C20H15NO4/c1-11(2)25-20(24)15-14-9-5-6-10-21(14)17-16(15)18(22)12-7-3-4-8-13(12)19(17)23/h3-11H,1-2H3
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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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM83550
PNG
(MLS000553953 | N-(4-Methoxy-benzylidene)-N'-[2...)
Show SMILES COc1ccc(CN=Nc2ccc(cc2S(=O)(=O)N2CCN(C)CC2)[N+]([O-])=O)cc1 |w:8.8|
Show InChI InChI=1S/C19H23N5O5S/c1-22-9-11-23(12-10-22)30(27,28)19-13-16(24(25)26)5-8-18(19)21-20-14-15-3-6-17(29-2)7-4-15/h3-8,13H,9-12,14H2,1-2H3
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n/an/an/an/a 8.43E+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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM83551
PNG
((2Z)-1-(4-chlorophenyl)-2-(7-methyl-[1,3]dioxolo[4...)
Show SMILES CN1\C(Sc2cc3OCOc3cc12)=C\C(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H12ClNO3S/c1-19-12-6-14-15(22-9-21-14)8-16(12)23-17(19)7-13(20)10-2-4-11(18)5-3-10/h2-8H,9H2,1H3/b17-7-
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n/an/an/an/a 6.23E+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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM83552
PNG
(2-(1,3-Dimethyl-2,6-dioxo-7-propyl-2,3,6,7-tetrahy...)
Show SMILES CCCn1c(SCC(=O)Nc2nc(cs2)-c2ccc(OC)cc2)nc2n(C)c(=O)n(C)c(=O)c12
Show InChI InChI=1S/C22H24N6O4S2/c1-5-10-28-17-18(26(2)22(31)27(3)19(17)30)25-21(28)34-12-16(29)24-20-23-15(11-33-20)13-6-8-14(32-4)9-7-13/h6-9,11H,5,10,12H2,1-4H3,(H,23,24,29)
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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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM83555
PNG
(3-amino-2-[(3-fluorobenzyl)thio]-4-keto-5-methyl-t...)
Show SMILES COC(=O)c1sc2nc(SCc3cccc(F)c3)n(N)c(=O)c2c1C
Show InChI InChI=1S/C16H14FN3O3S2/c1-8-11-13(25-12(8)15(22)23-2)19-16(20(18)14(11)21)24-7-9-4-3-5-10(17)6-9/h3-6H,7,18H2,1-2H3
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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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM83556
PNG
((6Z)-5-azanylidene-6-[[5-(4-methoxy-2-nitro-phenyl...)
Show SMILES COc1ccc(-c2ccc([CH+]c3c([NH-])n4c(C)csc4nc3=O)o2)c(c1)[N+]([O-])=O
Show InChI InChI=1S/C19H14N4O5S/c1-10-9-29-19-21-18(24)14(17(20)22(10)19)7-12-4-6-16(28-12)13-5-3-11(27-2)8-15(13)23(25)26/h3-9H,1-2H3,(H-,20,24)
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n/an/an/an/a 2.90E+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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM83558
PNG
(1-[4-[(4-chlorobenzyl)amino]-3-nitro-phenyl]-3-met...)
Show SMILES Cc1cc(O)n(c1O)-c1ccc(NCc2ccc(Cl)cc2)c(c1)[N+]([O-])=O
Show InChI InChI=1S/C18H16ClN3O4/c1-11-8-17(23)21(18(11)24)14-6-7-15(16(9-14)22(25)26)20-10-12-2-4-13(19)5-3-12/h2-9,20,23-24H,10H2,1H3
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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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM52448
PNG
((3E)-1H-indole-2,3-dione 3-[(4-fluorophenyl)hydraz...)
Show SMILES Fc1ccc(NNC2=c3ccccc3=NC2=O)cc1 |c:7,14|
Show InChI InChI=1S/C14H10FN3O/c15-9-5-7-10(8-6-9)17-18-13-11-3-1-2-4-12(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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM83575
PNG
((3-besyltriazolo[1,5-a]quinazolin-5-yl)-(2,5-dimet...)
Show SMILES Cc1ccc(C)c(Nc2nc3c(nnn3c3ccccc23)S(=O)(=O)c2ccccc2)c1
Show InChI InChI=1S/C23H19N5O2S/c1-15-12-13-16(2)19(14-15)24-21-18-10-6-7-11-20(18)28-22(25-21)23(26-27-28)31(29,30)17-8-4-3-5-9-17/h3-14H,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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM55031
PNG
((6Z)-5-azanylidene-2-methyl-6-[(5-nitrofuran-2-yl)...)
Show SMILES Cc1cn2c([NH-])c([CH+]c3ccc(o3)[N+]([O-])=O)c(=O)nc2s1
Show InChI InChI=1S/C12H8N4O4S/c1-6-5-15-10(13)8(11(17)14-12(15)21-6)4-7-2-3-9(20-7)16(18)19/h2-5H,1H3,(H-,13,17)
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n/an/an/an/a 2.38E+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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM51082
PNG
(2-[(2Z,5Z)-4-keto-2-(2-keto-3,3-dimethyl-butyliden...)
Show SMILES CCCNC(=O)Cn1\c(=C\C(=O)C(C)(C)C)s\c(=C/c2ccc(o2)-c2cccc(c2)[N+]([O-])=O)c1=O
Show InChI InChI=1S/C25H27N3O6S/c1-5-11-26-22(30)15-27-23(14-21(29)25(2,3)4)35-20(24(27)31)13-18-9-10-19(34-18)16-7-6-8-17(12-16)28(32)33/h6-10,12-14H,5,11,15H2,1-4H3,(H,26,30)/b20-13-,23-14-
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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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM47268
PNG
(2-(3-amino-2-cyano-3-oxo-1-propen-1-yl)-1H-indol-3...)
Show SMILES CC(=O)Oc1c(\C=C(/C#N)C(N)=O)[nH]c2ccccc12
Show InChI InChI=1S/C14H11N3O3/c1-8(18)20-13-10-4-2-3-5-11(10)17-12(13)6-9(7-15)14(16)19/h2-6,17H,1H3,(H2,16,19)/b9-6+
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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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM52488
PNG
((E)-2-cyano-3-[5-[4-(difluoromethylsulfanyl)phenyl...)
Show SMILES Cc1cc(NC(=O)C(=C\c2ccc(o2)-c2ccc(SC(F)F)cc2)\C#N)n(n1)-c1ccccc1
Show InChI InChI=1S/C25H18F2N4O2S/c1-16-13-23(31(30-16)19-5-3-2-4-6-19)29-24(32)18(15-28)14-20-9-12-22(33-20)17-7-10-21(11-8-17)34-25(26)27/h2-14,25H,1H3,(H,29,32)/b18-14+
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n/an/an/an/a 4.89E+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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM52493
PNG
(2,4-bis(chloranyl)-N-(2-methoxyphenazin-1-yl)benza...)
Show SMILES COc1ccc2nc3ccccc3nc2c1NC(=O)c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C20H13Cl2N3O2/c1-27-17-9-8-16-18(24-15-5-3-2-4-14(15)23-16)19(17)25-20(26)12-7-6-11(21)10-13(12)22/h2-10H,1H3,(H,25,26)
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n/an/an/an/a 2.76E+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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM83585
PNG
((4Z)-4-[4-(dimethylamino)benzylidene]-1-(2-furfury...)
Show SMILES COC(=O)C1=C(C)N(Cc2ccco2)C(=O)\C1=C/c1ccc(cc1)N(C)C |c:4|
Show InChI InChI=1S/C21H22N2O4/c1-14-19(21(25)26-4)18(12-15-7-9-16(10-8-15)22(2)3)20(24)23(14)13-17-6-5-11-27-17/h5-12H,13H2,1-4H3/b18-12-
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n/an/an/an/a 3.75E+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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM51116
PNG
((5E)-1-(3-bromophenyl)-5-[(1,2,5-trimethyl-3-pyrro...)
Show SMILES Cc1cc(C=C2C(=O)NC(=O)N(C2=O)c2cccc(Br)c2)c(C)n1C |w:4.3|
Show InChI InChI=1S/C18H16BrN3O3/c1-10-7-12(11(2)21(10)3)8-15-16(23)20-18(25)22(17(15)24)14-6-4-5-13(19)9-14/h4-9H,1-3H3,(H,20,23,25)
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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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM83587
PNG
((5-amino-1-methylsulfonylpyrazol-3-yl) 2-methyl-3-...)
Show SMILES Cc1c(cccc1[N+]([O-])=O)C(=O)Oc1cc(N)n(n1)S(C)(=O)=O
Show InChI InChI=1S/C12H12N4O6S/c1-7-8(4-3-5-9(7)16(18)19)12(17)22-11-6-10(13)15(14-11)23(2,20)21/h3-6H,13H2,1-2H3
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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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM83589
PNG
((5Z)-1-[(4-methoxyphenyl)methyl]-5-(1H-pyrrol-2-yl...)
Show SMILES COc1ccc(CN2C(=O)NC(=O)\C(=C\c3ccc[nH]3)C2=O)cc1
Show InChI InChI=1S/C17H15N3O4/c1-24-13-6-4-11(5-7-13)10-20-16(22)14(15(21)19-17(20)23)9-12-3-2-8-18-12/h2-9,18H,10H2,1H3,(H,19,21,23)/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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM57749
PNG
(2-(1,3-dihydrobenzimidazol-2-ylidene)-3-(5-nitro-2...)
Show SMILES [O-][N+](=O)c1ccc(o1)C(=O)[C-](C#N)c1[nH]c2ccccc2[nH+]1
Show InChI InChI=1S/C14H7N4O4/c15-7-8(13(19)11-5-6-12(22-11)18(20)21)14-16-9-3-1-2-4-10(9)17-14/h1-6H,(H,16,17)/q-1/p+1
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n/an/an/an/a 5.53E+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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM83593
PNG
(3-nitro-4-(2-oxidanylidenepyrrolidin-1-yl)benzenes...)
Show SMILES NNS(=O)(=O)c1ccc(N2CCCC2=O)c(c1)[N+]([O-])=O
Show InChI InChI=1S/C10H12N4O5S/c11-12-20(18,19)7-3-4-8(9(6-7)14(16)17)13-5-1-2-10(13)15/h3-4,6,12H,1-2,5,11H2
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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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM83615
PNG
(5-(4-bromobenzoyl)-2-(dimethylaminomethylene)-3-ke...)
Show SMILES CN(C)C=c1sc2c(cc(C(=O)c3ccc(Br)cc3)n2c1=O)C#N
Show InChI InChI=1S/C17H12BrN3O2S/c1-20(2)9-14-16(23)21-13(7-11(8-19)17(21)24-14)15(22)10-3-5-12(18)6-4-10/h3-7,9H,1-2H3
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n/an/an/an/a 2.23E+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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM51253
PNG
(MLS000756452 | N-[[4-(dimethylamino)benzylidene]am...)
Show SMILES CN(C)c1ccc(C=NNC(=O)c2cnc3ccccc3c2)cc1 |w:8.8|
Show InChI InChI=1S/C19H18N4O/c1-23(2)17-9-7-14(8-10-17)12-21-22-19(24)16-11-15-5-3-4-6-18(15)20-13-16/h3-13H,1-2H3,(H,22,24)
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n/an/an/an/a 2.64E+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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM66698
PNG
(MLS001185526 | N-[4-[2-(4-bromophenyl)ethanoylamin...)
Show SMILES COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC(=O)Cc1ccc(Br)cc1
Show InChI InChI=1S/C23H21BrN2O4/c1-29-20-14-19(26-23(28)16-6-4-3-5-7-16)21(30-2)13-18(20)25-22(27)12-15-8-10-17(24)11-9-15/h3-11,13-14H,12H2,1-2H3,(H,25,27)(H,26,28)
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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
Endoribonuclease toxin MazF


(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
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM73876
PNG
((4Z)-4-(2,5-dimethoxybenzylidene)-2-phenyl-2-oxazo...)
Show SMILES COc1ccc(OC)c(\C=C2/N=C(OC2=O)c2ccccc2)c1 |c:11|
Show InChI InChI=1S/C18H15NO4/c1-21-14-8-9-16(22-2)13(10-14)11-15-18(20)23-17(19-15)12-6-4-3-5-7-12/h3-11H,1-2H3/b15-11-
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n/an/an/an/a 3.91E+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%