BDBM801803 US12605353, Compound 58b::methyl 5-(3-(2-fluoro-N-propioloylbenzamido)propoxy)-4-methoxy-propiolamidobenzoate

SMILES C#CC(=O)Nc1cc(OC)c(OCCCN(C(=O)C#C)C(=O)c2ccccc2F)cc1C(=O)OC

InChI Key InChIKey=NTOPPKZXRSZYOR-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 = 801803   

TargetProtein disulfide-isomerase A4(Human)
Academia Sinica

US Patent
LigandChemical structure of BindingDB Monomer ID 801803BDBM801803(methyl 5-(3-(2-fluoro-N-propioloylbenzamido)propox...)
Affinity DataIC50: 4.20nMAssay Description:JAK1, JAK2, JAK3 and Tyk2 were purchased from Carna Biosciences, Inc. As the substrate, LANCE Ultra ULight-JAK1 Peptide (manufactured by PerkinElmer ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
8/31/2026
Entry Details
US Patent