BDBM50170862 CHEMBL191055::Octanoic acid (S)-1-methyl-2-octanoyloxy-diphosphoric acid

SMILES CCCCCCCC(=O)OC[C@H](CO[P@@](=O)(O)OP(=O)(O)O)OC(=O)CCCCCCC

InChI Key InChIKey=MBDSUZSCJLRKPC-UHFFFAOYSA-N

Data  2 KI  2 IC50

PDB links: 1 PDB ID matches this monomer.

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50170862   

TargetLysophosphatidic acid receptor 3(Human)
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50170862(Octanoic acid (S)-1-methyl-2-octanoyloxy-diphospho...)
Affinity DataIC50: 454nMAssay Description:Inhibition of LPA-induced calcium transients in RH7777 rat hepatoma cells expressing LPA3 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetLysophosphatidic acid receptor 1(Human)
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50170862(Octanoic acid (S)-1-methyl-2-octanoyloxy-diphospho...)
Affinity DataIC50: 5.50E+3nMAssay Description:Inhibition of LPA-induced calcium transients in RH7777 rat hepatoma cells expressing LPA1 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetLysophosphatidic acid receptor 3(Human)
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50170862(Octanoic acid (S)-1-methyl-2-octanoyloxy-diphospho...)
Affinity DataKi:  202nMAssay Description:Binding affinity for Lysophosphatidic acid receptor 3 expressed in RH7777 rat hepatoma cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetLysophosphatidic acid receptor 1(Human)
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50170862(Octanoic acid (S)-1-methyl-2-octanoyloxy-diphospho...)
Affinity DataKi:  4.30E+3nMAssay Description:Binding affinity for Lysophosphatidic acid receptor 1 expressed in RH7777 rat hepatoma cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed