Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adenosine receptor A3' and Ligand = 'BDBM50221690'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50221690 ((E)-9-(2-(cinnamyloxy)ethyl)-1,3-dimethyl-6,7,8,9-...) Show SMILES Cn1c2nc3N(CCOC\C=C\c4ccccc4)CCCn3c2c(=O)n(C)c1=O Show InChI InChI=1S/C21H25N5O3/c1-23-18-17(19(27)24(2)21(23)28)26-12-7-11-25(20(26)22-18)13-15-29-14-6-10-16-8-4-3-5-9-16/h3-6,8-10H,7,11-15H2,1-2H3/b10-6+	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Displacement of [3H]PSB11 from human adenosine A3 receptor expressed in CHO cells				Bioorg Med Chem 15: 6956-74 (2007) Article DOI: 10.1016/j.bmc.2007.07.051 BindingDB Entry DOI: 10.7270/Q26W99TB
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