Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adenosine receptor A2a' and Ligand = 'BDBM561404'   

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 A2a (Homo sapiens (Human))	BDBM561404 (3-(4-amino-7-(3-methylpyridin-4-yl)-2-(pyridin-2-y...) Show SMILES Cc1cnccc1-c1c(nc(N)c2nn(Cc3ccccn3)nc12)-c1cccc(c1)C#N |(2.51,1.54,;1.17,2.31,;1.17,3.85,;-.16,4.62,;-1.49,3.85,;-1.49,2.31,;-.16,1.54,;-.16,,;-1.49,-.77,;-1.49,-2.31,;-.16,-3.08,;-.16,-4.62,;1.17,-2.31,;2.64,-2.79,;3.54,-1.54,;5.08,-1.54,;5.85,-.21,;5.08,1.13,;5.85,2.46,;7.39,2.46,;8.16,1.13,;7.39,-.21,;2.64,-.29,;1.17,-.77,;-2.83,,;-2.83,1.54,;-4.16,2.31,;-5.5,1.54,;-5.5,,;-4.16,-.77,;-6.83,-.77,;-8.16,-1.54,)| Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Stably transfected HEK-293 cells expressing the human adenosine A2A receptor (Perkin Elmer) are maintained in MEM culture medium with 10% FBS and 400...				Citation and Details BindingDB Entry DOI: 10.7270/Q2MK6H4B
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