BDBM776932 US20250313535, Compound 642

SMILES O=C(O)[C@H](Cc1cccc2c(-c3nccc4c(CN5CCCCC5)cccc34)cccc12)NC(=O)C1(C(F)(F)F)CCN([C@@H]2COCC2(F)F)CC1

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 = 776932   

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

US Patent
LigandPNGBDBM776932(US20250313535, Compound 642)
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 Info
In Depth
Date in BDB:
1/26/2026
Entry Details
US Patent

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

US Patent
LigandPNGBDBM776932(US20250313535, Compound 642)
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 Info
In Depth
Date in BDB:
1/26/2026
Entry Details
US Patent