Brief Information of the Compound and Protein
Compound Name
 Compound Info 
(S)-3-[4-(4-biphenyl-4-yl-piperazin-1-yl)-phenyl]-2-{[(S)-1-(toluene-4-sulfonyl)-pyrrolidine-2-carbonyl]-amino}-propionic acid
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 PubChem ID
CID: 44446221
Canonical SMILES
Cc1ccc(cc1)S(=O)(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(cc1)N1CCN(CC1)c1ccc(cc1)-c1ccccc1)C(O)=O
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Compound Formula C37H40N4O5S
Compound Structure
Protein Name
 Protein Info 
Integrin alpha-4
Protein Classification
Membrane receptor
Uniprot ID
P13612
Gene Name
ITGA4
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000001 Jurkat
 Cell Line Info 
Homo sapiens (Human)  1
1
IC50 = 450 nM
   TI
   LI
   LO
   TS