BDBM106370 9-(ortho-fluorobenzyl)-2-phenyl-azaadenine (1bis)

SMILES: Nc1nc(nc2n(Cc3ccccc3F)nnc12)-c1ccccc1

InChI Key: InChIKey=NXRBUSNWTZFORH-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 = 106370   

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))	BDBM106370 (9-(ortho-fluorobenzyl)-2-phenyl-azaadenine (1bis)) Show SMILES Nc1nc(nc2n(Cc3ccccc3F)nnc12)-c1ccccc1 Show InChI InChI=1S/C17H13FN6/c18-13-9-5-4-8-12(13)10-24-17-14(22-23-24)15(19)20-16(21-17)11-6-2-1-3-7-11/h1-9H,10H2,(H2,19,20,21)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	3.80	n/a	n/a	n/a	n/a	n/a	n/a	7.4	n/a
Universit£ di Pisa					Assay Description For A1 adenosine receptors, 40 mg of protein were incubated for 60 min at 25°C with [3H]DPCPX 0.5 nM (Kd = 0.4 nM) and increasing concentrations...				Chem Biol Drug Des 82: 22-38 (2013) Article DOI: 10.1111/cbdd.12131 BindingDB Entry DOI: 10.7270/Q2445K4Z
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM106370 (9-(ortho-fluorobenzyl)-2-phenyl-azaadenine (1bis)) Show SMILES Nc1nc(nc2n(Cc3ccccc3F)nnc12)-c1ccccc1 Show InChI InChI=1S/C17H13FN6/c18-13-9-5-4-8-12(13)10-24-17-14(22-23-24)15(19)20-16(21-17)11-6-2-1-3-7-11/h1-9H,10H2,(H2,19,20,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	94	n/a	n/a	n/a	n/a	n/a	n/a	7.4	n/a
Universit£ di Pisa					Assay Description For A1 adenosine receptors, 40 mg of protein were incubated for 60 min at 25°C with [3H]DPCPX 0.5 nM (Kd = 0.4 nM) and increasing concentrations...				Chem Biol Drug Des 82: 22-38 (2013) Article DOI: 10.1111/cbdd.12131 BindingDB Entry DOI: 10.7270/Q2445K4Z
					More data for this Ligand-Target Pair