Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adenosine receptor A3' and Ligand = 'BDBM50091129'   

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))	BDBM50091129 (CHEMBL106520 | Cyclopentyl-(2-phenyl-2H-pyrazolo[3...) Show SMILES C1CCC(C1)Nc1nc2ccccc2c2cn(nc12)-c1ccccc1 Show InChI InChI=1S/C21H20N4/c1-2-10-16(11-3-1)25-14-18-17-12-6-7-13-19(17)23-21(20(18)24-25)22-15-8-4-5-9-15/h1-3,6-7,10-15H,4-5,8-9H2,(H,22,23)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	60.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universita' di Firenze Curated by ChEMBL					Assay Description Displacement of specific [125I]-AB-MECA binding at human adenosine A3 receptor expressed in CHO cells				J Med Chem 43: 3118-24 (2000) BindingDB Entry DOI: 10.7270/Q28S4P52
					More data for this Ligand-Target Pair