BDBM54092 2,3-Dihydro-benzo[1,4]dioxine-2-carboxylic acid [1-(2-hydroxy-3-methyl-5-nitro-phenyl)-meth-(Z)-ylidene]-hydrazide::MLS000766677::N'-[(E)-(5-methyl-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide::N'-[(E)-(5-methyl-3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]-2,3-dihydro-1,4-benzodioxin-3-carbohydrazide::N'-[(E)-(5-methyl-3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide::N'-[(E)-(6-keto-5-methyl-3-nitro-cyclohexa-2,4-dien-1-ylidene)methyl]-2,3-dihydro-1,4-benzodioxin-3-carbohydrazide::SMR000414652::cid_5910965

SMILES Cc1cc(c[c-](\C=[NH+]\NC(=O)C2COc3ccccc3O2)c1=O)[N+]([O-])=O

InChI Key InChIKey=FLXJUDUNVMSWHR-QGMBQPNBSA-O

Data  6 IC50

  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 6 hits for monomerid = 54092   

TargetM1 family aminopeptidase(Plasmodium falciparum (isolate FcB1 / Columbia))
Srmlsc

Curated by PubChem BioAssay
LigandPNGBDBM54092(2,3-Dihydro-benzo[1,4]dioxine-2-carboxylic acid [1...)
Affinity DataIC50:  3.05E+3nMAssay Description:Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetCaspase-3(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54092(2,3-Dihydro-benzo[1,4]dioxine-2-carboxylic acid [1...)
Affinity DataIC50:  1.76E+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 DepthDetails PCBioAssay
TargetAlbumin(Bos taurus)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM54092(2,3-Dihydro-benzo[1,4]dioxine-2-carboxylic acid [1...)
Affinity DataIC50: >9.42E+4nMMore data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetSentrin-specific protease 6(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54092(2,3-Dihydro-benzo[1,4]dioxine-2-carboxylic acid [1...)
Affinity DataIC50:  2.84E+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 DepthDetails PCBioAssay
TargetT cell receptor alpha variable 4(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM54092(2,3-Dihydro-benzo[1,4]dioxine-2-carboxylic acid [1...)
Affinity DataIC50: >9.42E+4nMMore data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetSentrin-specific protease 8(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54092(2,3-Dihydro-benzo[1,4]dioxine-2-carboxylic acid [1...)
Affinity DataIC50:  4.21E+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 DepthDetails PCBioAssay