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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adenosine receptor A2a/A2b' and Ligand = 'BDBM50014268'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Adenosine receptor A2a/A2b


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50014268
PNG
(2-(4-Chloro-phenyl)-5,6-dimethyl-7H-pyrrolo[2,3-d]...)
Show SMILES Cc1[nH]c2nc(nc(N)c2c1C)-c1ccc(Cl)cc1
Show InChI InChI=1S/C14H13ClN4/c1-7-8(2)17-14-11(7)12(16)18-13(19-14)9-3-5-10(15)6-4-9/h3-6H,1-2H3,(H3,16,17,18,19)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
3.56E+4n/an/an/an/an/an/an/an/a



National Institute of Diabetes

Curated by ChEMBL


Assay Description
Binding affinity against Adenosine A2 receptor from rat striatal membrane using [3H]NECA as radioligand


J Med Chem 33: 2822-8 (1990)


BindingDB Entry DOI: 10.7270/Q27D2T4D
More data for this
Ligand-Target Pair