BDBM50018680 CHEMBL3291293

SMILES: CCCCCCC#Cc1nc(N)c2ncn(CC)c2n1

InChI Key: InChIKey=JFVSDLCYVKKSJL-UHFFFAOYSA-N

Data: 1 IC50

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 = 50018680   

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 A2a (Rattus norvegicus (rat))	BDBM50018680 (CHEMBL3291293) Show SMILES CCCCCCC#Cc1nc(N)c2ncn(CC)c2n1 Show InChI InChI=1S/C15H21N5/c1-3-5-6-7-8-9-10-12-18-14(16)13-15(19-12)20(4-2)11-17-13/h11H,3-8H2,1-2H3,(H2,16,18,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Yamasa Corporation Curated by ChEMBL					Assay Description Antagonist activity at adenosine A2A receptor in 5-HT-treated Wistar rat femoral vein assessed as inhibition of 2-octyn-1-yladenosine-induced vasodil...				Bioorg Med Chem 22: 3072-82 (2014) Article DOI: 10.1016/j.bmc.2014.04.041 BindingDB Entry DOI: 10.7270/Q2348MXH
					More data for this Ligand-Target Pair