BDBM50156654 (6RS,9aRS)-2-furan-2-yl-5-[6-(pyridin-3-yloxymethyl)-octahydro-pyrido[1,2-a]pyrazin-2-yl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-ylamine::CHEMBL222532

SMILES: Nc1cc(nc2nc(nn12)-c1ccco1)N1CCN2[C@@H](COc3cccnc3)CCC[C@H]2C1

InChI Key: InChIKey=NVKOPDWEMXIWRT-DLBZAZTESA-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 = 50156654   

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))	BDBM50156654 ((6RS,9aRS)-2-furan-2-yl-5-[6-(pyridin-3-yloxymethy...) Show SMILES Nc1cc(nc2nc(nn12)-c1ccco1)N1CCN2[C@@H](COc3cccnc3)CCC[C@H]2C1 |r| Show InChI InChI=1S/C23H26N8O2/c24-20-12-21(26-23-27-22(28-31(20)23)19-7-3-11-32-19)29-9-10-30-16(14-29)4-1-5-17(30)15-33-18-6-2-8-25-13-18/h2-3,6-8,11-13,16-17H,1,4-5,9-10,14-15,24H2/t16-,17+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Biogen Idec Inc. Curated by ChEMBL					Assay Description Displacement of [3H]ZM241385 from adenosine A2A receptor in rat brain membrane				J Med Chem 47: 6218-29 (2004) Article DOI: 10.1021/jm0494321 BindingDB Entry DOI: 10.7270/Q20V8DM9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Rattus norvegicus (rat))	BDBM50156654 ((6RS,9aRS)-2-furan-2-yl-5-[6-(pyridin-3-yloxymethy...) Show SMILES Nc1cc(nc2nc(nn12)-c1ccco1)N1CCN2[C@@H](COc3cccnc3)CCC[C@H]2C1 |r| Show InChI InChI=1S/C23H26N8O2/c24-20-12-21(26-23-27-22(28-31(20)23)19-7-3-11-32-19)29-9-10-30-16(14-29)4-1-5-17(30)15-33-18-6-2-8-25-13-18/h2-3,6-8,11-13,16-17H,1,4-5,9-10,14-15,24H2/t16-,17+/m0/s1	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 Displacement of [3h]DPCPX from adenosine A receptor in rat cerebral cortex membrane				J Med Chem 47: 6218-29 (2004) Article DOI: 10.1021/jm0494321 BindingDB Entry DOI: 10.7270/Q20V8DM9
					More data for this Ligand-Target Pair