BDBM50499697 CHEMBL3742187

SMILES: Cl.[H][C@]12CN(Cc3ccccc3)C(=N)N1CCCC2

InChI Key: InChIKey=QOKABUAIKASFLE-ZOWNYOTGSA-N

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 = 50499697   

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 (Homo sapiens (Human))	BDBM50499697 (CHEMBL3742187) Show SMILES Cl.[H][C@]12CN(Cc3ccccc3)C(=N)N1CCCC2 |r| Show InChI InChI=1S/C14H19N3.ClH/c15-14-16(10-12-6-2-1-3-7-12)11-13-8-4-5-9-17(13)14;/h1-3,6-7,13,15H,4-5,8-11H2;1H/t13-;/m0./s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Lille Curated by ChEMBL					Assay Description Displacement of [3H]-ZM24135 from human adenosine A2A receptor expressed in HEK293 cells after 1 hr by scintillation counting				Eur J Med Chem 106: 15-25 (2015) Article DOI: 10.1016/j.ejmech.2015.10.030 BindingDB Entry DOI: 10.7270/Q2K64N3P
					More data for this Ligand-Target Pair