BDBM300927 US10131658, Compound 197

SMILES [#6]-[#6]-[#7](-[#6]-[#6])-c1ccc2-[#6](=[#6]-3-[#6]=[#6]\[#6](-[#6]-[#6]-3-[#8]-c2c1)=[#7+](/[#6]-[#6])-[#6]-[#6])-c1ccc(cc1S([#8-])(=O)=O)S(=O)(=O)[#7]-[#8]-[#6]-[#6]-[#8]-[#6]-[#6]-[#8]-[#6]-[#6]-[#8]-[#6]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#7]-[#6](-[#7])=[#7])-[#6](=O)-[#7]-c1ccc(-[#6]-[#6@H](-[#7]-[#6](=O)-[#6]-2-[#6]-[#6]-[#6]-[#7]-2S(=O)(=O)c2ccccc2)-[#6](-[#8])=O)cc1

InChI Key InChIKey=CYMIMCJQXGBSIZ-UHFFFAOYSA-M

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 300927   

TargetIntegrin alpha-5/beta-1 [T112H](Human)
University of California

US Patent
LigandPNGBDBM300927(US10131658, Compound 197)
Affinity DataIC50: 505nMAssay Description:A panel of cell lines and integrin ligands were developed to allow rapid examination of potency and specificity of inhibitors against all 8 integrins...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/28/2019
Entry Details
US Patent