BDBM50335719 CHEMBL1650364::N-2,6-bis4-fluorophenyl)pyrimidin-4-yl)acetamide

SMILES: CC(=O)Nc1cc(nc(n1)-c1ccc(F)cc1)-c1ccc(F)cc1

InChI Key: InChIKey=SPDULAIJUXWFCT-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50335719   

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 A3 (Homo sapiens (Human))	BDBM50335719 (CHEMBL1650364 | N-2,6-bis4-fluorophenyl)pyrimidin-...) Show SMILES CC(=O)Nc1cc(nc(n1)-c1ccc(F)cc1)-c1ccc(F)cc1 Show InChI InChI=1S/C18H13F2N3O/c1-11(24)21-17-10-16(12-2-6-14(19)7-3-12)22-18(23-17)13-4-8-15(20)9-5-13/h2-10H,1H3,(H,21,22,23,24)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	16.7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Santiago de Compostela Curated by ChEMBL					Assay Description Displacement of [3H]NECA from human adenosine A3 receptor expressed in human HeLa cells by liquid scintillation counting				J Med Chem 54: 457-71 (2011) Article DOI: 10.1021/jm100843z BindingDB Entry DOI: 10.7270/Q28P60SK
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50335719 (CHEMBL1650364 | N-2,6-bis4-fluorophenyl)pyrimidin-...) Show SMILES CC(=O)Nc1cc(nc(n1)-c1ccc(F)cc1)-c1ccc(F)cc1 Show InChI InChI=1S/C18H13F2N3O/c1-11(24)21-17-10-16(12-2-6-14(19)7-3-12)22-18(23-17)13-4-8-15(20)9-5-13/h2-10H,1H3,(H,21,22,23,24)	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	1.33E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Santiago de Compostela Curated by ChEMBL					Assay Description Displacement of [3H]ZM2413853 from human adenosine A2A receptor expressed in human HeLa cells by liquid scintillation counting				J Med Chem 54: 457-71 (2011) Article DOI: 10.1021/jm100843z BindingDB Entry DOI: 10.7270/Q28P60SK
					More data for this Ligand-Target Pair