BDBM97466 US8470800, C

SMILES: O[C@@H]1[C@@H](COS(=O)(=O)O[Na])O[C@H]([C@@H]1O)n1cnc2c(NC3CCCC3)ncnc12

InChI Key: InChIKey=SYHNGKRBPFJKCW-DNBRLMRSSA-M

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 = 97466   

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 (Homo sapiens (Human))	BDBM97466 (US8470800, C) Show SMILES O[C@@H]1[C@@H](COS(=O)(=O)O[Na])O[C@H]([C@@H]1O)n1cnc2c(NC3CCCC3)ncnc12 |r| Show InChI InChI=1S/C15H21N5O7S.Na/c21-11-9(5-26-28(23,24)25)27-15(12(11)22)20-7-18-10-13(16-6-17-14(10)20)19-8-3-1-2-4-8;/h6-9,11-12,15,21-22H,1-5H2,(H,16,17,19)(H,23,24,25);/q;+1/p-1/t9-,11-,12-,15-;/m1./s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	4.05	-10.6	n/a	n/a	n/a	n/a	n/a	7.4	4
Inotek Pharmaceuticals Corporation US Patent					Assay Description Radioligand binding assay using adenosine receptor.				US Patent US8470800 (2013) BindingDB Entry DOI: 10.7270/Q2SQ8Z0M
					More data for this Ligand-Target Pair