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BDBM50159496 CHEMBL3785381

SMILES: CC(C)OC(=O)C1=C(C)Nc2nccn2C1c1ccco1

InChI Key: InChIKey=XSFNZYDKVKNNMU-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50159496   
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 A2b


(Homo sapiens (Human))
BDBM50159496
PNG
(CHEMBL3785381)
Show SMILES CC(C)OC(=O)C1=C(C)Nc2nccn2C1c1ccco1
Show InChI InChI=1S/C15H17N3O3/c1-9(2)21-14(19)12-10(3)17-15-16-6-7-18(15)13(12)11-5-4-8-20-11/h4-9,13H,1-3H3,(H,16,17)
NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
86n/an/an/an/an/an/an/an/a



Uppsala University

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human Adenosine A2B receptor expressed in HEK293 cells after 30 mins


J Med Chem 59: 1967-83 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01586
BindingDB Entry DOI: 10.7270/Q2QF8VS9
More data for this
Ligand-Target Pair