BDBM50018403 8-Furan-2-yl-1,3-dipropyl-2-thioxo-1,2,3,7-tetrahydro-purin-6-one::CHEMBL55356

SMILES: CCCn1c2nc([nH]c2c(=O)n(CCC)c1=S)-c1ccco1

InChI Key: InChIKey=XXFQMMBDEDVFDD-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 = 50018403   

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 A1 (Rattus norvegicus (rat))	BDBM50018403 (8-Furan-2-yl-1,3-dipropyl-2-thioxo-1,2,3,7-tetrahy...) Show SMILES CCCn1c2nc([nH]c2c(=O)n(CCC)c1=S)-c1ccco1 Show InChI InChI=1S/C15H18N4O2S/c1-3-7-18-13-11(14(20)19(8-4-2)15(18)22)16-12(17-13)10-6-5-9-21-10/h5-6,9H,3-4,7-8H2,1-2H3,(H,16,17)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	32	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NIDDK Curated by ChEMBL					Assay Description Inhibition of binding of 1 nM [3H]N-6-(phenylisopropyl)adenosine to adenosine A1 receptor in rat cortical membranes				J Med Chem 32: 1873-9 (1989) BindingDB Entry DOI: 10.7270/Q2708213
					More data for this Ligand-Target Pair
Adenosine A2 receptor (Rattus norvegicus-Rattus norvegicus (rat))	BDBM50018403 (8-Furan-2-yl-1,3-dipropyl-2-thioxo-1,2,3,7-tetrahy...) Show SMILES CCCn1c2nc([nH]c2c(=O)n(CCC)c1=S)-c1ccco1 Show InChI InChI=1S/C15H18N4O2S/c1-3-7-18-13-11(14(20)19(8-4-2)15(18)22)16-12(17-13)10-6-5-9-21-10/h5-6,9H,3-4,7-8H2,1-2H3,(H,16,17)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	594	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NIDDK Curated by ChEMBL					Assay Description Inhibition of binding of [3H]5'-(N-ethylcarbamoyl)-adenosine to adenosine A2 receptor in rat striatal membranes				J Med Chem 32: 1873-9 (1989) BindingDB Entry DOI: 10.7270/Q2708213
					More data for this Ligand-Target Pair