BDBM50091741 (S)-4-Hydroxy-3-[2-(1-oxo-7-piperazin-1-yl-3,4-dihydro-1H-isoquinolin-2-yl)-acetylamino]-butyric acid::CHEMBL57094

SMILES OC[C@H](CC(O)=O)NC(=O)CN1CCc2ccc(cc2C1=O)N1CCNCC1

InChI Key InChIKey=GUPDJDZREMBCHF-AWEZNQCLSA-N

Data  1 IC50  2 Kd

  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 3 hits for monomerid = 50091741   

TargetIntegrin alpha-IIb/beta-3(Homo sapiens (Human))
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50091741((S)-4-Hydroxy-3-[2-(1-oxo-7-piperazin-1-yl-3,4-dih...)
Affinity DataIC50:  81nMAssay Description:Competition with [1251]L-692,884 for binding to purified alpha IIb/beta3 integrin, activated by coating onto yttrium silicate scintillation proximity...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetIntegrin alpha-IIb/beta-3(Homo sapiens (Human))
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50091741((S)-4-Hydroxy-3-[2-(1-oxo-7-piperazin-1-yl-3,4-dih...)
Affinity DataKd: >1.00E+3nMAssay Description:Competition with [1251]L-692,884 for binding to purified alpha IIb/beta3 integrin, activated by coating onto yttrium silicate scintillation proximity...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetIntegrin alpha-IIb/beta-3(Homo sapiens (Human))
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50091741((S)-4-Hydroxy-3-[2-(1-oxo-7-piperazin-1-yl-3,4-dih...)
Affinity DataKd:  15nMAssay Description:Binding affinity to resting form of alpha IIb/beta3 integrin by flow cytometry using fluorescein ligand L-726,745 displacement from human platelets.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed