BDBM77552 5-[2-(2-pyridinylmethylidene)hydrazinyl]-2H-1,2,4-triazin-3-one::5-[2-(pyridin-2-ylmethylidene)hydrazinyl]-2H-1,2,4-triazin-3-one::5-[N'-(2-pyridylmethylene)hydrazino]-2H-1,2,4-triazin-3-one::MLS000685728::SMR000312692::cid_4603494::pyridine-2-carbaldehyde (3-oxo-2,3-dihydro-1,2,4-triazin-5-yl)hydrazone

SMILES C[C@]12CCC(=CCC3CNC3)CC1[C@@H](CO)C(=O)C1C2CC[C@]2(C)C(=O)CCC12

InChI Key InChIKey=MKXXYUQDXLTGKU-UHFFFAOYSA-N

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 = 77552   

TargetSodium/potassium-transporting ATPase subunit alpha-1(Dog)
Vanderbilt Screening Center For Gpcrs, Ion Channels and Transporters

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 77552BDBM77552((6S,10R,13S)-3-(2-(azetidin-3-yl)ethylidene)-6-(hy...)
Affinity DataIC50: 2.90E+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:
5/4/2026
Entry Details
US Patent