BDBM50208900 CHEMBL396365::sodium 4-[(4-butoxyphenyl)thio]-20-[1-hydroxy-4-[(5-hydroxyundecyl)oxy]but-2-yn-1-yl]biphenyl-3-sulfonate
SMILES: CCCCOc1ccc(Sc2ccc(cc2S([O-])(=O)=O)-c2ccccc2C(O)C#CCOCCCCCCCCCCCO)cc1
InChI Key: InChIKey=TYIUBTHHZBNEOE-UHFFFAOYSA-M
Data: 1 IC50
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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Sphingosine 1-phosphate receptor 1 (Homo sapiens (Human)) | BDBM50208900 (CHEMBL396365 | sodium 4-[(4-butoxyphenyl)thio]-20-...) | PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 130 | n/a | n/a | n/a | n/a | n/a | n/a |
Sankyo Co., Ltd Curated by ChEMBL | Assay Description Antagonist activity at human S1P1 receptor expressed in CHO cell membrane by cAMP assay | Bioorg Med Chem 15: 3548-64 (2007) Article DOI: 10.1016/j.bmc.2007.02.048 BindingDB Entry DOI: 10.7270/Q2NP258T | |||||||||||
More data for this Ligand-Target Pair |