Brief Information of the Compound and Protein
Compound Name
 Compound Info 
(S)-3-(4-(4-(2,6-dicyanophenyl)piperazin-1-yl)phenyl)-2-((S)-1-(phenylsulfonyl)pyrrolidine-2-carboxamido)propanoic acid
    Show/Hide
 PubChem ID
CID: 44446233
Canonical SMILES
OC(=O)[C@H](Cc1ccc(cc1)N1CCN(CC1)c1c(cccc1C#N)C#N)NC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccccc1
    Show/Hide
Compound Formula C32H32N6O5S
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 = 19 nM
   TI
   LI
   LO
   TS