BDBM83721 6,7-dichloro-2-hydroxy-1,1-diketo-3-(2-keto-2-methoxy-ethyl)-4H-1,2,4-benzothiadiazine-3-carboxylic acid methyl ester::6,7-dichloro-2-hydroxy-3-(2-methoxy-2-oxoethyl)-1,1-dioxo-4H-1,2,4-benzothiadiazine-3-carboxylic acid methyl ester::MLS002920772::SMR001798358::cid_294721::methyl 6,7-bis(chloranyl)-3-(2-methoxy-2-oxidanylidene-ethyl)-2-oxidanyl-1,1-bis(oxidanylidene)-4H-1,2,4-benzothiadiazine-3-carboxylate::methyl 6,7-dichloro-2-hydroxy-3-(2-methoxy-2-oxoethyl)-1,1-dioxo-4H-1,2,4-benzothiadiazine-3-carboxylate

SMILES COC(=O)CC1(Nc2cc(Cl)c(Cl)cc2S(=O)(=O)N1O)C(=O)OC

InChI Key InChIKey=HXJIDAFJSVKUFH-UHFFFAOYSA-N

Data  2 IC50  2 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 83721   

TargetEndoribonuclease toxin MazF(Escherichia coli (strain K12))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM83721(SMR001798358 | MLS002920772 | cid_294721 | methyl ...)
Affinity DataEC50:  1.14E+3nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/5/2012
Entry Details
PCBioAssay
TargetAlbumin(Bovine)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM83721(SMR001798358 | MLS002920772 | cid_294721 | methyl ...)
Affinity DataIC50: 9.42E+4nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2013
Entry Details
PCBioAssay
TargetT cell receptor alpha variable 4(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM83721(SMR001798358 | MLS002920772 | cid_294721 | methyl ...)
Affinity DataIC50: 9.42E+4nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2013
Entry Details
PCBioAssay
TargetEndoribonuclease toxin MazF(Escherichia coli (strain K12))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM83721(SMR001798358 | MLS002920772 | cid_294721 | methyl ...)
Affinity DataEC50: >9.90E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/5/2012
Entry Details
PCBioAssay