BDBM50152239 2-Furan-2-yl-N*7*-{2-[4-(2,4,6-trifluoro-phenyl)-piperazin-1-yl]-ethyl}-[1,2,4]triazolo[1,5-c]pyrimidine-5,7-diamine::CHEMBL185107

SMILES: Nc1nc(NCCN2CCN(CC2)c2c(F)cc(F)cc2F)cc2nc(nn12)-c1ccco1

InChI Key: InChIKey=RXALMGKAHHEOOI-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 = 50152239   

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))	BDBM50152239 (2-Furan-2-yl-N*7*-{2-[4-(2,4,6-trifluoro-phenyl)-p...) Show SMILES Nc1nc(NCCN2CCN(CC2)c2c(F)cc(F)cc2F)cc2nc(nn12)-c1ccco1 Show InChI InChI=1S/C21H21F3N8O/c22-13-10-14(23)19(15(24)11-13)31-7-5-30(6-8-31)4-3-26-17-12-18-28-20(16-2-1-9-33-16)29-32(18)21(25)27-17/h1-2,9-12,26H,3-8H2,(H2,25,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	92	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Biogen Idec, Inc. Curated by ChEMBL					Assay Description Binding affinity against Adenosine A2a receptor determined using [3H]-ZM-241,385 as radioligand				Bioorg Med Chem Lett 14: 4835-8 (2004) Article DOI: 10.1016/j.bmcl.2004.07.048 BindingDB Entry DOI: 10.7270/Q27S7N8T
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Rattus norvegicus (rat))	BDBM50152239 (2-Furan-2-yl-N*7*-{2-[4-(2,4,6-trifluoro-phenyl)-p...) Show SMILES Nc1nc(NCCN2CCN(CC2)c2c(F)cc(F)cc2F)cc2nc(nn12)-c1ccco1 Show InChI InChI=1S/C21H21F3N8O/c22-13-10-14(23)19(15(24)11-13)31-7-5-30(6-8-31)4-3-26-17-12-18-28-20(16-2-1-9-33-16)29-32(18)21(25)27-17/h1-2,9-12,26H,3-8H2,(H2,25,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>500	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Biogen Idec, Inc. Curated by ChEMBL					Assay Description Binding affinity against Adenosine A1 receptor from rat cerebral cortex was determined using [3H]-DPCPX as radioligand				Bioorg Med Chem Lett 14: 4835-8 (2004) Article DOI: 10.1016/j.bmcl.2004.07.048 BindingDB Entry DOI: 10.7270/Q27S7N8T
					More data for this Ligand-Target Pair