BDBM776839 US20250313535, Compound 548

SMILES CC1(C(=O)N[C@@H](Cc2cccc3c(-c4nccc5ccc(CCCN6CCCCC6)cc45)cccc23)C(=O)O)CC2CCC(C1)N2CC(F)(F)F

InChI Key

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 776839   

TargetIntegrin alpha-4/beta-7(Human)
Dice Molecules Sv

US Patent
LigandChemical structure of BindingDB Monomer ID 776839BDBM776839(US20250313535, Compound 548)
Affinity DataIC50: 10nMAssay Description:MAdCAM (R&D Systems, 0.1 ug) was diluted in 50 μL PBS, added to each well of an opaque ELISA plate (Thermo), and incubated overnight at 4° C. Coated ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
1/26/2026
Entry Details
US Patent

TargetIntegrin alpha-4/beta-1(Human)
Dice Molecules Sv

US Patent
LigandChemical structure of BindingDB Monomer ID 776839BDBM776839(US20250313535, Compound 548)
Affinity DataIC50: 275nMAssay Description:MAdCAM (R&D Systems, 0.1 ug) was diluted in 50 μL PBS, added to each well of an opaque ELISA plate (Thermo), and incubated overnight at 4° C. Coated ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
1/26/2026
Entry Details
US Patent