BDBM50169320 7-{3-[4-(4-Fluoro-phenyl)-piperidin-1-ylmethyl]-phenyl}-2-furan-2-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-ylamine::CHEMBL176550

SMILES: Nc1nc(cc2nc(nn12)-c1ccco1)-c1cccc(CN2CCC(CC2)c2ccc(F)cc2)c1

InChI Key: InChIKey=VKPDXSINQQPTFB-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 = 50169320   

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 Receptors A2a (A2a) (Rattus norvegicus (rat))	BDBM50169320 (7-{3-[4-(4-Fluoro-phenyl)-piperidin-1-ylmethyl]-ph...) Show SMILES Nc1nc(cc2nc(nn12)-c1ccco1)-c1cccc(CN2CCC(CC2)c2ccc(F)cc2)c1 Show InChI InChI=1S/C27H25FN6O/c28-22-8-6-19(7-9-22)20-10-12-33(13-11-20)17-18-3-1-4-21(15-18)23-16-25-31-26(24-5-2-14-35-24)32-34(25)27(29)30-23/h1-9,14-16,20H,10-13,17H2,(H2,29,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.40	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 In vitro ability to displace [3H]-SCH-58,261 from A2A adenosine receptor in Rat				Bioorg Med Chem Lett 15: 3670-4 (2005) Article DOI: 10.1016/j.bmcl.2005.05.086 BindingDB Entry DOI: 10.7270/Q279446R
					More data for this Ligand-Target Pair