BDBM17904 4-{[(2S,4S)-4-fluoro-1-{2-[3-methoxy-4-({[2-(propan-2-yl)phenyl]carbamoyl}amino)phenyl]acetyl}pyrrolidin-2-yl]methoxy}benzoic acid::benzoic acid derivative, 12e

SMILES COc1cc(CC(=O)N2C[C@@H](F)C[C@H]2COc2ccc(cc2)C(O)=O)ccc1NC(=O)Nc1ccccc1C(C)C

InChI Key InChIKey=MSLKEFBOXBUEPF-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 17904   

TargetIntegrin alpha-4/beta-1 [T112H](Human)
Daiichi Pharmaceutical

LigandPNGBDBM17904(4-{[(2S,4S)-4-fluoro-1-{2-[3-methoxy-4-({[2-(propa...)
Affinity DataIC50: 769nMpH: 7.5 T: 2°CAssay Description:The 4B4 cells expressing VLA-4 were distributed into each well of a 96-well culture plate for 2 days. Compound and Eu-labeled Human VCAM-1/Fc Chimera...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/18/2007
Entry Details Article
PubMed