null

SMILES CN1CCc2c(C1)sc1c2c(NCc2ccco2)nc2nnnn12

InChI Key InChIKey=PTGSXOOXZPPXTP-UHFFFAOYSA-N

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 29628   

TargetRunt-related transcription factor 1(Homo sapiens (Human))
Burnham Center for Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM29628(MLS000042566 | SMR000047335 | cid_666073)copy SMILEScopy InChI
Affinity DataIC50: 5.63E+4nMpH: 7.4 T: 2°CAssay Description:This assay is to use HTS to identify inhibitors of the protein-protein interaction between the RUNX1 Runt domain and CBFbeta-SMMHC, a potential thera...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2DV1H7PPCBioAssay
TargetNuclear receptor subfamily 4 group A member 1(Homo sapiens (Human))
Burnham Center for Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM29628(MLS000042566 | SMR000047335 | cid_666073)copy SMILEScopy InChI
Affinity DataIC50: 3.88E+4nMAssay Description:Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (San Diego, CA) NIH Molecular Libraries Screening Cen...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q29C6VTKPCBioAssay
TargetRunt-related transcription factor 1(Homo sapiens (Human))
Burnham Center for Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM29628(MLS000042566 | SMR000047335 | cid_666073)copy SMILEScopy InChI
Affinity DataIC50: 5.63E+4nMpH: 7.4 T: 2°CAssay Description:This assay is to identify inhibitors of the protein-protein interaction between the RUNX1 Runt domain and CBFbeta-SMMHC. This is accomplished by usin...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2T72FSXPCBioAssay