BDBM50111235 (S)-3-[4-(2,6-Dichloro-benzyloxy)-phenyl]-2-(3,4-dioxo-2-propylamino-cyclobut-1-enylamino)-propionic acid::CHEMBL276027

SMILES CCCNc1c(N[C@@H](Cc2ccc(OCc3c(Cl)cccc3Cl)cc2)C(O)=O)c(=O)c1=O

InChI Key InChIKey=HZWMCIZXLOUGLF-UHFFFAOYSA-N

Data  2 IC50

  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 = 50111235   

TargetIntegrin alpha-4/beta-1(Human)
Celltech R&D

Curated by ChEMBL
LigandPNGBDBM50111235((S)-3-[4-(2,6-Dichloro-benzyloxy)-phenyl]-2-(3,4-d...)
Affinity DataIC50: 1.83E+4nMAssay Description:Inhibition of Jurkat cell VLA-4 adhesion to VCAM-1More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetIntegrin alpha-4/beta-1(Human)
Celltech R&D

Curated by ChEMBL
LigandPNGBDBM50111235((S)-3-[4-(2,6-Dichloro-benzyloxy)-phenyl]-2-(3,4-d...)
Affinity DataIC50: 67nMAssay Description:Inhibition of very late antigen-4 (VLA-4)/vascular cell adhesion molecule-1(VCAM -1) interactionMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed