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BDBM50273148 CHEMBL4125802

SMILES: Nc1cccn2cc(nc12)-c1ccco1

InChI Key: InChIKey=AVXUZCBFDCELCN-UHFFFAOYSA-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 = 50273148   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Adenosine receptor A2a


(Homo sapiens (Human))
BDBM50273148
PNG
(CHEMBL4125802)
Show SMILES Nc1cccn2cc(nc12)-c1ccco1
Show InChI InChI=1S/C11H9N3O/c12-8-3-1-5-14-7-9(13-11(8)14)10-4-2-6-15-10/h1-7H,12H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Universities of Lille

Curated by ChEMBL


Assay Description
Displacement of [3H]-ZM-241385 from human adenosine A2A receptor expressed in HEK293 cell membranes after 1 hr by scintillation counting analysis


Bioorg Med Chem 26: 3296-3307 (2018)


Article DOI: 10.1016/j.bmc.2018.04.057
BindingDB Entry DOI: 10.7270/Q20867VR
More data for this
Ligand-Target Pair