BDBM50114306 (S)-2-(6-Benzyl-pyrimidin-4-ylamino)-3-{4-[(3,5-dichloro-pyridine-4-carbonyl)-amino]-phenyl}-propionic acid::CHEMBL417698

SMILES OC(=O)[C@H](Cc1ccc(NC(=O)c2c(Cl)cncc2Cl)cc1)Nc1cc(Cc2ccccc2)ncn1

InChI Key InChIKey=JYJPAGKEGSTXHZ-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 = 50114306   

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

Curated by ChEMBL
LigandPNGBDBM50114306((S)-2-(6-Benzyl-pyrimidin-4-ylamino)-3-{4-[(3,5-di...)
Affinity DataIC50: 1.10E+3nMAssay Description:Inhibition of very late antigen 4 expressed in Jurkat cell line, in a cell-based adhesion assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/22/2013
Entry Details Article
PubMed
TargetIntegrin alpha-4/beta-1(Human)
Celltech R&D

Curated by ChEMBL
LigandPNGBDBM50114306((S)-2-(6-Benzyl-pyrimidin-4-ylamino)-3-{4-[(3,5-di...)
Affinity DataIC50: 40nMAssay Description:Inhibition of very late antigen 4 from HL60 lysate in a protein-based ligand binding assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/22/2013
Entry Details Article
PubMed