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4 similar compounds to monomer 88839

Compile data set for download or QSAR
Wt: 370.3
BDBM41505
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Wt: 320.3
BDBM41489
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Wt: 332.3
BDBM57998
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Wt: 330.3
BDBM83529
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 16 hits for monomerid = 41505,41489,57998,83529   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Ephrin type-B receptor 4 (EphB4)


(Homo sapiens (Human))
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/a>7.94E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2KP80J0
More data for this
Ligand-Target Pair
corticotropin releasing factor-binding protein


(Homo sapiens (Human))
BDBM41505
PNG
((4Z)-4-[(2-methyl-1H-indol-3-yl)methylene]-2-[4-(t...)
Show SMILES Cc1[nH]c2ccccc2c1\C=C1/N=C(OC1=O)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C20H13F3N2O2/c1-11-15(14-4-2-3-5-16(14)24-11)10-17-19(26)27-18(25-17)12-6-8-13(9-7-12)20(21,22)23/h2-10,24H,1H3/b17-10-
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n/an/an/an/a 1.02E+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 (2012)


BindingDB Entry DOI: 10.7270/Q2VX0F3D
More data for this
Ligand-Target Pair
BZLF2


(Human herpesvirus 4 type 2)
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/a 1.93E+3n/an/an/an/an/an/a



Emory University Molecular Libraries Screening Center

Curated by PubChem BioAssay


Assay Description
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Theodore Jardetzky; Northw...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2057DCW
More data for this
Ligand-Target Pair
POsterior Segregation family member (pos-1)


(Caenorhabditis elegans)
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 3.00E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Broad Institute: MLPCN maternal gene expression Project ID: 2024 Keywords: Zinc finger, C. elegans, maternal gene expression, RNA-protein interac...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q28G8J4C
More data for this
Ligand-Target Pair
RecName: Full=Zinc finger protein mex-5


(Caenorhabditis elegans)
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 5.53E+3n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Broad Institute: MLPCN maternal gene expression Project ID: 2024 Keywords: Zinc finger, C. elegans, maternal gene expression, RNA-protein interac...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2D798VP
More data for this
Ligand-Target Pair
streptokinase A precursor


(Streptococcus pyogenes M1 GAS)
BDBM57998
PNG
((4Z)-2-(4-methoxyphenyl)-4-[(2-methyl-1H-indol-3-y...)
Show SMILES COc1ccc(cc1)C1=N\C(=C/c2c(C)[nH]c3ccccc23)C(=O)O1
Show InChI InChI=1S/C20H16N2O3/c1-12-16(15-5-3-4-6-17(15)21-12)11-18-20(23)25-19(22-18)13-7-9-14(24-2)10-8-13/h3-11,21H,1-2H3/b18-11-
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n/an/an/an/a 1.50E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Group A streptococcus, GAS, streptokinase, expression, virulence, inhibition, dose response, EC50 Assay Overview: The goal of this assa...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2736PBV
More data for this
Ligand-Target Pair
streptokinase A precursor


(Streptococcus pyogenes M1 GAS)
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 1.66E+4n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Group A streptococcus, GAS, streptokinase, expression, virulence, inhibition, dose response, EC50 Assay Overview: The goal of this assa...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2736PBV
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens (Human))
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>2.60E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens (Human))
BDBM57998
PNG
((4Z)-2-(4-methoxyphenyl)-4-[(2-methyl-1H-indol-3-y...)
Show SMILES COc1ccc(cc1)C1=N\C(=C/c2c(C)[nH]c3ccccc23)C(=O)O1
Show InChI InChI=1S/C20H16N2O3/c1-12-16(15-5-3-4-6-17(15)21-12)11-18-20(23)25-19(22-18)13-7-9-14(24-2)10-8-13/h3-11,21H,1-2H3/b18-11-
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n/an/an/an/a>5.00E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
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>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/Q2Z31X54
More data for this
Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE


(Escherichia coli str. K-12 substr. MG1655)
BDBM41505
PNG
((4Z)-4-[(2-methyl-1H-indol-3-yl)methylene]-2-[4-(t...)
Show SMILES Cc1[nH]c2ccccc2c1\C=C1/N=C(OC1=O)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C20H13F3N2O2/c1-11-15(14-4-2-3-5-16(14)24-11)10-17-19(26)27-18(25-17)12-6-8-13(9-7-12)20(21,22)23/h2-10,24H,1H3/b17-10-
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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/Q2Z31X54
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/Q2Z31X54
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)
BDBM41505
PNG
((4Z)-4-[(2-methyl-1H-indol-3-yl)methylene]-2-[4-(t...)
Show SMILES Cc1[nH]c2ccccc2c1\C=C1/N=C(OC1=O)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C20H13F3N2O2/c1-11-15(14-4-2-3-5-16(14)24-11)10-17-19(26)27-18(25-17)12-6-8-13(9-7-12)20(21,22)23/h2-10,24H,1H3/b17-10-
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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)
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
Ephrin type-B receptor 4 (EphB4)


(Homo sapiens (Human))
BDBM41505
PNG
((4Z)-4-[(2-methyl-1H-indol-3-yl)methylene]-2-[4-(t...)
Show SMILES Cc1[nH]c2ccccc2c1\C=C1/N=C(OC1=O)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C20H13F3N2O2/c1-11-15(14-4-2-3-5-16(14)24-11)10-17-19(26)27-18(25-17)12-6-8-13(9-7-12)20(21,22)23/h2-10,24H,1H3/b17-10-
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n/an/a>7.94E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2KP80J0
More data for this
Ligand-Target Pair