Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adenosine receptor A2b' and Ligand = 'BDBM50170951'   

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 A2b (Homo sapiens (Human))	BDBM50170951 (2-(2-Chloro-phenyl)-2,5-dihydro-pyrazolo[4,3-c]qui...) Show SMILES Clc1ccccc1-n1cc2c(n1)c1ccccc1[nH]c2=O Show InChI InChI=1S/C16H10ClN3O/c17-12-6-2-4-8-14(12)20-9-11-15(19-20)10-5-1-3-7-13(10)18-16(11)21/h1-9H,(H,18,21)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Università di Ferrara Curated by ChEMBL					Assay Description Inhibition of 100 nM-NECA stimulation of cAMP levels in human adenosine A2b receptor expressing CHO cells				J Med Chem 48: 5001-8 (2005) Article DOI: 10.1021/jm050125k BindingDB Entry DOI: 10.7270/Q24749DW
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