BDBM38601 7-(3,4-dimethylanilino)-6-(2-methylphenyl)-7H-pyrrolo[3,4-b]pyridin-5-one::7-(3,4-dimethylanilino)-6-(o-tolyl)-7H-pyrrolo[3,4-b]pyridin-5-one::7-[(3,4-dimethylphenyl)amino]-6-(2-methylphenyl)-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one::7-[(3,4-dimethylphenyl)amino]-6-(2-methylphenyl)-7H-pyrrolo[3,4-b]pyridin-5-one::MLS000045804::SMR000028201::cid_3240143

SMILES Cc1ccc(Nc2n(-c3ccccc3C)c(=O)c3ccc[nH]c23)cc1C

InChI Key InChIKey=DWOQCAVPMNTNBT-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:
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 38601   

TargetMevalonate kinase(Streptococcus pneumoniae D39)
Srmlsc

Curated by PubChem BioAssay
LigandPNGBDBM38601(SMR000028201 | 7-[(3,4-dimethylphenyl)amino]-6-(2-...)
Affinity DataIC50: 5.60E+3nMAssay Description:Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/29/2011
Entry Details
PCBioAssay
TargetMevalonate kinase(Streptococcus pneumoniae D39)
Srmlsc

Curated by PubChem BioAssay
LigandPNGBDBM38601(SMR000028201 | 7-[(3,4-dimethylphenyl)amino]-6-(2-...)
Affinity DataIC50: 1.00E+7nMAssay Description:Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/29/2011
Entry Details
PCBioAssay
TargetMevalonate kinase(Streptococcus pneumoniae D39)
Srmlsc

Curated by PubChem BioAssay
LigandPNGBDBM38601(SMR000028201 | 7-[(3,4-dimethylphenyl)amino]-6-(2-...)
Affinity DataIC50: 3.61E+3nMAssay Description:Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/30/2011
Entry Details
PCBioAssay
LigandPNGBDBM38601(SMR000028201 | 7-[(3,4-dimethylphenyl)amino]-6-(2-...)
Affinity DataIC50: 9.59E+3nMAssay Description:Dose Response Confirmation for Small Molecule Inhibitors of Eukaryotic Translation Initiation NIH Molecular Libraries Screening Centers Network [MLSC...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/30/2011
Entry Details
PCBioAssay
TargetKallikrein-5(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM38601(SMR000028201 | 7-[(3,4-dimethylphenyl)amino]-6-(2-...)
Affinity DataIC50: 5.53E+3nMAssay Description:Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Scott L. Diamond, University of Pennsy...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/8/2011
Entry Details
PCBioAssay
TargetHexokinase HKDC1 [W721R](Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM38601(SMR000028201 | 7-[(3,4-dimethylphenyl)amino]-6-(2-...)
Affinity DataIC50: 1.16E+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:
8/3/2011
Entry Details
PCBioAssay
TargetHexokinase HKDC1 [W721R](Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM38601(SMR000028201 | 7-[(3,4-dimethylphenyl)amino]-6-(2-...)
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:
8/4/2011
Entry Details
PCBioAssay