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BDBM50138469 CHEMBL3754014

SMILES: Cc1nc2cn(Cc3ccccc3)nc2c(=O)[nH]1

InChI Key: InChIKey=XVYFMRVBLCIOFC-UHFFFAOYSA-N

Data: 1 KI

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50138469   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Adenosine receptor A3


(Homo sapiens (Human))
BDBM50138469
PNG
(CHEMBL3754014)
Show SMILES Cc1nc2cn(Cc3ccccc3)nc2c(=O)[nH]1
Show InChI InChI=1S/C13H12N4O/c1-9-14-11-8-17(16-12(11)13(18)15-9)7-10-5-3-2-4-6-10/h2-6,8H,7H2,1H3,(H,14,15,18)
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KEGG

UniProtKB/SwissProt

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GoogleScholar
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
485n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Displacement of [125I]AB-MECA at human A3A receptor expressed in CHO cell membrane after 60 mins by scintillation counting method


Eur J Med Chem 108: 117-33 (2016)


Article DOI: 10.1016/j.ejmech.2015.11.015
BindingDB Entry DOI: 10.7270/Q2NK3GWZ
More data for this
Ligand-Target Pair