BDBM77531 4-(5-Methyl-3-nitro-pyrazol-1-ylmethyl)-benzoic acid [1-(2,4-dihydroxy-phenyl)-meth-(E)-ylidene]-hydrazide::4-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]-N'-[(E)-(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]benzohydrazide::MLS000588514::N'-[(E)-(2-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methyl]-4-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]benzohydrazide::N'-[(E)-(2-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-4-[(5-methyl-3-nitro-1-pyrazolyl)methyl]benzohydrazide::N'-[(E)-(2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-4-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzohydrazide::SMR000219920::cid_5522397

SMILES C[C@]12CC/C(=C\CC3CNC3)CC1[C@@H](O)C[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12

InChI Key InChIKey=WMVBZPNDLUXGDJ-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 = 77531   

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 77531BDBM77531((E)-3-[2-(azetidin-3-yl)ethyliden]-6alpha-hydroxya...)
Affinity DataIC50: 7.00E+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