BDBM50163415 2-Furan-2-yl-N*5*-methyl-N*5*-[(R)-1-(5-methyl-isoxazol-3-ylmethyl)-piperidin-2-ylmethyl]-[1,2,4]triazolo[1,5-a][1,3,5]triazine-5,7-diamine::CHEMBL366472

SMILES: CN(C[C@H]1CCCCN1Cc1cc(C)on1)c1nc(N)n2nc(nc2n1)-c1ccco1

InChI Key: InChIKey=BLMCWULLZFZSKV-OAHLLOKOSA-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 = 50163415   

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))	BDBM50163415 (2-Furan-2-yl-N*5*-methyl-N*5*-[(R)-1-(5-methyl-iso...) Show SMILES CN(C[C@H]1CCCCN1Cc1cc(C)on1)c1nc(N)n2nc(nc2n1)-c1ccco1 Show InChI InChI=1S/C20H25N9O2/c1-13-10-14(26-31-13)11-28-8-4-3-6-15(28)12-27(2)19-23-18(21)29-20(24-19)22-17(25-29)16-7-5-9-30-16/h5,7,9-10,15H,3-4,6,8,11-12H2,1-2H3,(H2,21,22,23,24,25)/t15-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	14	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Biogen Idec, Inc. Curated by ChEMBL					Assay Description Inhibition of [3H]ZM-241385 binding to adenosine A2a receptor of rat brain tissue				J Med Chem 48: 2009-18 (2005) Article DOI: 10.1021/jm0498396 BindingDB Entry DOI: 10.7270/Q2NZ88FB
					More data for this Ligand-Target Pair