BDBM50039681 4-Fluorosulfonyl-benzoic acid 3-(8-cyclopentyl-2,6-dioxo-3-propyl-2,3,6,7-tetrahydro-purin-1-yl)-propyl ester::CHEMBL90702
SMILES: CCCn1c2nc([nH]c2c(=O)n(CCCOC(=O)c2ccc(cc2)S(F)(=O)=O)c1=O)C1CCCC1
InChI Key: InChIKey=XMBCEKSLDYYQEL-UHFFFAOYSA-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 |
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Adenosine receptor A1 (Homo sapiens (Human)) | BDBM50039681 (4-Fluorosulfonyl-benzoic acid 3-(8-cyclopentyl-2,6...) | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 87 | n/a | n/a | n/a | n/a | n/a | n/a |
University of South Florida Curated by ChEMBL | Assay Description Inhibition of specific binding of [3H]-CPX to the A1 adenosine receptor in DDT1 MF-2 (DDT) cells. | J Med Chem 37: 2704-12 (1994) BindingDB Entry DOI: 10.7270/Q24748X6 | |||||||||||
More data for this Ligand-Target Pair |