BDBM50332928 (3S)-1-bromo-3-hydroxy-4-(stearoyloxy)butylphosphonic acid::CHEMBL1632624
SMILES: CCCCCCCCCCCCCCCCCC(=O)OC[C@@H](O)CC(Br)P(O)(O)=O
InChI Key: InChIKey=PFFHBTVVORAHDE-BGERDNNASA-N
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
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Ectonucleotide pyrophosphatase/phosphodiesterase family member 2 (Homo sapiens (Human)) | BDBM50332928![]() ((3S)-1-bromo-3-hydroxy-4-(stearoyloxy)butylphospho...) | PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem | Article PubMed | 4.01E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Virginia Curated by ChEMBL | Assay Description Inhibition of autotoxin assessed as choline release from LPC using lysophosphatidylcholine as substrate | Bioorg Med Chem Lett 20: 7132-6 (2010) Article DOI: 10.1016/j.bmcl.2010.09.030 BindingDB Entry DOI: 10.7270/Q2TD9XMV | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2 (Homo sapiens (Human)) | BDBM50332928![]() ((3S)-1-bromo-3-hydroxy-4-(stearoyloxy)butylphospho...) | PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem | Article PubMed | n/a | n/a | 170 | n/a | n/a | n/a | n/a | n/a | n/a |
Technical University of Lodz Curated by ChEMBL | Assay Description Inhibition of human recombinant autotaxin expressed in insect Sf9 cells using FS-3 as substrate preincubated for 10 mins prior substrate addition mea... | Bioorg Med Chem Lett 22: 2698-700 (2012) Article DOI: 10.1016/j.bmcl.2012.03.008 BindingDB Entry DOI: 10.7270/Q27P90DG | |||||||||||
More data for this Ligand-Target Pair |