BDBM77589 5-Nitro-furan-2-carboxylic acid (2-pyridin-4-yl-benzooxazol-5-yl)-amide::5-nitro-N-(2-pyridin-4-yl-1,3-benzoxazol-5-yl)-2-furancarboxamide::5-nitro-N-(2-pyridin-4-yl-1,3-benzoxazol-5-yl)furan-2-carboxamide::5-nitro-N-[2-(4-pyridyl)-1,3-benzoxazol-5-yl]-2-furamide::MLS001219988::SMR000608097::cid_2866290

SMILES O=C1CCCc2c1sc(Nc1ccc(I)cc1F)c2C(=O)NC[C@@H](O)CO

InChI Key InChIKey=KCSCYIVJVSRGFZ-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 77589   

TargetMitogen-activated protein kinase kinase kinase 1(Human)
Vanderbilt Screening Center For Gpcrs, Ion Channels and Transporters

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 77589BDBM77589(US20250387379, Compound 4.035)
Affinity DataIC50: 150nMAssay 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