BDBM77564 2-Amino-7-methyl-4-(5-nitro-furan-2-yl)-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carbonitrile::2-amino-5-keto-7-methyl-4-(5-nitro-2-furyl)-4H-pyrano[3,2-c]pyran-3-carbonitrile::2-amino-7-methyl-4-(5-nitro-2-furanyl)-5-oxo-4H-pyrano[3,2-c]pyran-3-carbonitrile::2-amino-7-methyl-4-(5-nitrofuran-2-yl)-5-oxo-4H-pyrano[3,2-c]pyran-3-carbonitrile::2-azanyl-7-methyl-4-(5-nitrofuran-2-yl)-5-oxidanylidene-4H-pyrano[3,2-c]pyran-3-carbonitrile::MLS001030012::SMR000427213::cid_3367286

SMILES N#Cc1ccc(C(=O)N2CC(O)C2)c(Nc2ccc(I)cc2F)c1

InChI Key InChIKey=CCSSFCBMCAHMND-UHFFFAOYSA-O

Data  1 IC50

  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 1 hit for monomerid = 77564   

TargetMitogen-activated protein kinase kinase kinase 1(Human)
Nflection Therapeutics

US Patent
LigandChemical structure of BindingDB Monomer ID 77564BDBM77564(US20250387379, Compound 1.002)
Affinity DataIC50: 1.50E+3nMAssay 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