BDBM50256094 CHEMBL482161::N7-ethyl-N7-(4-fluorophenethyl)-2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]pyrimidine-5,7-diamine

SMILES: CCN(CCc1ccc(F)cc1)c1cc2nc(nn2c(N)n1)-c1ccco1

InChI Key: InChIKey=ROCACWRRIUHWHQ-UHFFFAOYSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50256094   

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
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50256094 (CHEMBL482161 | N7-ethyl-N7-(4-fluorophenethyl)-2-(...) Show SMILES CCN(CCc1ccc(F)cc1)c1cc2nc(nn2c(N)n1)-c1ccco1 Show InChI InChI=1S/C19H19FN6O/c1-2-25(10-9-13-5-7-14(20)8-6-13)16-12-17-22-18(15-4-3-11-27-15)24-26(17)19(21)23-16/h3-8,11-12H,2,9-10H2,1H3,(H2,21,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Displacement of [3H]SCH58261 from human adenosine A2A receptor expressed in HEK293 cells				Bioorg Med Chem Lett 19: 967-71 (2009) Article DOI: 10.1016/j.bmcl.2008.11.075 BindingDB Entry DOI: 10.7270/Q2CC10KT
					More data for this Ligand-Target Pair