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Compile Data Set for Download or QSAR

Found 4 hits of ic50 for monomerid = 54526   
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
Tumor necrosis factor


(Homo sapiens (Human))
BDBM54526
PNG
(MLS001159274 | N-[3-(diethylsulfamoyl)phenyl]-2-(3...)
Show SMILES CCN(CC)S(=O)(=O)c1cccc(NC(=O)CNc2cccc(c2)S(=O)(=O)N2CCCC2)c1
Show InChI InChI=1S/C22H30N4O5S2/c1-3-25(4-2)32(28,29)21-12-8-10-19(16-21)24-22(27)17-23-18-9-7-11-20(15-18)33(30,31)26-13-5-6-14-26/h7-12,15-16,23H,3-6,13-14,17H2,1-2H3,(H,24,27)
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n/an/a 2.55E+3n/an/an/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 (2010)


BindingDB Entry DOI: 10.7270/Q25M6443
More data for this
Ligand-Target Pair
COUP transcription factor 2


(Homo sapiens (Human))
BDBM54526
PNG
(MLS001159274 | N-[3-(diethylsulfamoyl)phenyl]-2-(3...)
Show SMILES CCN(CC)S(=O)(=O)c1cccc(NC(=O)CNc2cccc(c2)S(=O)(=O)N2CCCC2)c1
Show InChI InChI=1S/C22H30N4O5S2/c1-3-25(4-2)32(28,29)21-12-8-10-19(16-21)24-22(27)17-23-18-9-7-11-20(15-18)33(30,31)26-13-5-6-14-26/h7-12,15-16,23H,3-6,13-14,17H2,1-2H3,(H,24,27)
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n/an/a 3.33E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q21Z431S
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))
BDBM54526
PNG
(MLS001159274 | N-[3-(diethylsulfamoyl)phenyl]-2-(3...)
Show SMILES CCN(CC)S(=O)(=O)c1cccc(NC(=O)CNc2cccc(c2)S(=O)(=O)N2CCCC2)c1
Show InChI InChI=1S/C22H30N4O5S2/c1-3-25(4-2)32(28,29)21-12-8-10-19(16-21)24-22(27)17-23-18-9-7-11-20(15-18)33(30,31)26-13-5-6-14-26/h7-12,15-16,23H,3-6,13-14,17H2,1-2H3,(H,24,27)
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n/an/a 3.47E+3n/an/an/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 (2010)


BindingDB Entry DOI: 10.7270/Q23R0R8T
More data for this
Ligand-Target Pair
Tegument protein VP16


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM54526
PNG
(MLS001159274 | N-[3-(diethylsulfamoyl)phenyl]-2-(3...)
Show SMILES CCN(CC)S(=O)(=O)c1cccc(NC(=O)CNc2cccc(c2)S(=O)(=O)N2CCCC2)c1
Show InChI InChI=1S/C22H30N4O5S2/c1-3-25(4-2)32(28,29)21-12-8-10-19(16-21)24-22(27)17-23-18-9-7-11-20(15-18)33(30,31)26-13-5-6-14-26/h7-12,15-16,23H,3-6,13-14,17H2,1-2H3,(H,24,27)
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n/an/a 8.54E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


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


PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q2GM85ZT
More data for this
Ligand-Target Pair