BDBM50203766 (4R)-2-(3-((4-chloro-2-isopropyl-6-methylphenoxy)methyl)-4-methoxyphenyl)thiazolidine-4-carboxylic acid::CHEMBL218126
SMILES: COc1ccc(cc1COc1c(C)cc(Cl)cc1C(C)C)C1N[C@@H](CS1)C(O)=O
InChI Key: InChIKey=YNLQBLLKNVJCCJ-YMXDCFFPSA-N
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Sphingosine 1-phosphate receptor 3 (Homo sapiens (Human)) | BDBM50203766 ((4R)-2-(3-((4-chloro-2-isopropyl-6-methylphenoxy)m...) | PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem | Article PubMed | n/a | n/a | >2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TOA EIYO Ltd. Curated by ChEMBL | Assay Description Antagonist activity against human S1P3 receptor assessed as inhibition of S1P-induced intracellular calcium mobilization in CHO-K1 cells | J Med Chem 50: 442-54 (2007) Article DOI: 10.1021/jm060834d BindingDB Entry DOI: 10.7270/Q2NG4Q84 | |||||||||||
More data for this Ligand-Target Pair |