BDBM51096 2-amino-1-amyl-3-(1,3-benzoxazol-2-yl)-6-methyl-4-nitro-pyrrolo[2,3-d]pyridazin-7-one::2-amino-3-(1,3-benzoxazol-2-yl)-6-methyl-4-nitro-1-pentyl-7-pyrrolo[2,3-d]pyridazinone::2-amino-3-(1,3-benzoxazol-2-yl)-6-methyl-4-nitro-1-pentylpyrrolo[2,3-d]pyridazin-7-one::2-azanyl-3-(1,3-benzoxazol-2-yl)-6-methyl-4-nitro-1-pentyl-pyrrolo[2,3-d]pyridazin-7-one::MLS000389744::SMR000256018::cid_4963271

SMILES CCCCCn1c(N)c(-c2nc3ccccc3o2)c2c(nn(C)c(=O)c12)[N+]([O-])=O

InChI Key InChIKey=PBERWSCWYDTVLM-UHFFFAOYSA-N

Data  7 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 7 hits for monomerid = 51096   

TargetGlycoprotein 42(HHV-4)
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM51096(2-amino-3-(1,3-benzoxazol-2-yl)-6-methyl-4-nitro-1...)
Affinity DataIC50: 8.69E+3nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Theodore Jardetzky; Northw...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/30/2011
Entry Details
PCBioAssay
TargetNeutrophil cytosol factor 1 [S99G](Human)
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM51096(2-amino-3-(1,3-benzoxazol-2-yl)-6-methyl-4-nitro-1...)
Affinity DataIC50: 5.00E+4nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Susan Smith, Emory Univers...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/7/2011
Entry Details
PCBioAssay
LigandPNGBDBM51096(2-amino-3-(1,3-benzoxazol-2-yl)-6-methyl-4-nitro-1...)
Affinity DataIC50: 3.06E+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:
1/4/2012
Entry Details
PCBioAssay
TargetTyrosine-protein phosphatase non-receptor type 5(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM51096(2-amino-3-(1,3-benzoxazol-2-yl)-6-methyl-4-nitro-1...)
Affinity DataIC50: 8.00E+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:
6/19/2012
Entry Details
PCBioAssay
TargetDual specificity protein phosphatase 3(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM51096(2-amino-3-(1,3-benzoxazol-2-yl)-6-methyl-4-nitro-1...)
Affinity DataIC50: 343nMAssay 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:
6/19/2012
Entry Details
PCBioAssay
TargetTyrosine-protein phosphatase non-receptor type 11(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM51096(2-amino-3-(1,3-benzoxazol-2-yl)-6-methyl-4-nitro-1...)
Affinity DataIC50: 738nMAssay 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:
6/19/2012
Entry Details
PCBioAssay
TargetTyrosine-protein phosphatase non-receptor type 5(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM51096(2-amino-3-(1,3-benzoxazol-2-yl)-6-methyl-4-nitro-1...)
Affinity DataIC50: 8.00E+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:
6/25/2012
Entry Details
PCBioAssay