BDBM31361 US11116760, Example 235

SMILES CCOCc1cc(OC)c(-c2ccc(C[C@H](NC(=O)c3c(Cl)cc4[nH]ccc4c3Cl)C(=O)O)c3cccnc23)c(OC)c1

InChI Key InChIKey=JMKWDMYKEHZMCJ-UHFFFAOYSA-N

Data  1 EC50

  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 1 hit for monomerid = 31361   

TargetIntegrin alpha-4/beta-7(Human)
Gilead Sciences

US Patent
LigandChemical structure of BindingDB Monomer ID 31361BDBM31361(US11116760, Example 235)
Affinity DataEC50:  2.30nMAssay Description:HEK293 cells (ATCC) were transiently transfected with recombinant NOS and grown. Cells were trypsinized, resuspended to 5 00,000 cells/mL, and plated...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/23/2026
Entry Details
US Patent