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.

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50170862   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Lysophosphatidic acid receptor 3 (Human)	BDBM50170862 (Octanoic acid (S)-1-methyl-2-octanoyloxy-diphospho...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	454	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Lysophosphatidic acid receptor 1 (Human)	BDBM50170862 (Octanoic acid (S)-1-methyl-2-octanoyloxy-diphospho...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Lysophosphatidic acid receptor 3 (Human)	BDBM50170862 (Octanoic acid (S)-1-methyl-2-octanoyloxy-diphospho...) Show SMILES Show InChI	GoogleScholar	UniChem		202	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Lysophosphatidic acid receptor 1 (Human)	BDBM50170862 (Octanoic acid (S)-1-methyl-2-octanoyloxy-diphospho...) Show SMILES Show InChI	GoogleScholar	UniChem		4.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair