BDBM776852 US20250313535, Compound 561

SMILES CC1(C)CCN(Cc2cccc3c(-c4cccc5c(C[C@H](NC(=O)C6(C(F)(F)F)CCN(CC(F)(F)F)CC6)C(=O)O)cccc45)nccc23)CC1

InChI Key

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 776852   

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

US Patent
LigandPNGBDBM776852(US20250313535, Compound 561)
Affinity DataIC50: 10nMMore 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
LigandPNGBDBM776852(US20250313535, Compound 561)
Affinity DataIC50: 275nMMore data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
1/26/2026
Entry Details US Patent