BDBM79918 (4Z)-6-amino-4-(3-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)-3-methyl-1-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile::(4Z)-6-amino-4-(3-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)-3-methyl-1-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile::(4Z)-6-amino-4-(3-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)-3-methyl-1-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile::(4Z)-6-azanyl-3-methyl-4-(3-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-1-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile::MLS001214474::SMR000543790::cid_17577761

SMILES CN1CCC(c2ccc(-c3ccc4c(c3)C(=O)N(C(C(=O)Nc3nccs3)c3cccc(F)c3)CO4)cc2)CC1

InChI Key InChIKey=PUBOKMCVMUTDEI-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 79918   

TargetEpidermal growth factor receptor [T790M,L858R](Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 79918BDBM79918(US20250388573, Compound 001)
Affinity DataIC50: 0.400nMAssay Description:Keywords: apoptosis, BH3 domain, Bcl2-A1, BIM, caspase, cancer Primary Collaborator: Todd Golub, Broad Institute, golub@broadinstitute.org Assay Over...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/6/2026
Entry Details
US Patent

TargetEpidermal growth factor receptor [L858R](Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 79918BDBM79918(US20250388573, Compound 001)
Affinity DataIC50: 2.80nMAssay Description:Keywords: apoptosis, BH3 domain, Bcl2-A1, BIM, caspase, cancer Primary Collaborator: Todd Golub, Broad Institute, golub@broadinstitute.org Assay Over...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/6/2026
Entry Details
US Patent