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PubMed code 8809156

Compile data set for download or QSAR
Found 2 hits of Enzyme Inhibition Constant Data   
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 A1 receptor


(GUINEA PIG)
BDBM50053171
PNG
(4-Benzyl-2-dimethylamino-pyrimidine-5-carboxylic a...)
Show SMILES COC(=O)c1cnc(nc1Cc1ccccc1)N(C)C
Show InChI InChI=1S/C15H17N3O2/c1-18(2)15-16-10-12(14(19)20-3)13(17-15)9-11-7-5-4-6-8-11/h4-8,10H,9H2,1-3H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.13E+4n/an/an/an/an/an/a



Università di Padova

Curated by ChEMBL


Assay Description
Inhibition of [3H]-CHA binding to Adenosine A1 receptor in guinea pig heart


J Med Chem 39: 3671-83 (1996)


Article DOI: 10.1021/jm9508649
BindingDB Entry DOI: 10.7270/Q2HQ3Z07
More data for this
Ligand-Target Pair
Adenosine A1 receptor


(GUINEA PIG)
BDBM50053172
PNG
(4-Benzyl-2-dimethylamino-pyrimidine-5-carboxylic a...)
Show SMILES CN(C)c1ncc(C(O)=O)c(Cc2ccccc2)n1
Show InChI InChI=1S/C14H15N3O2/c1-17(2)14-15-9-11(13(18)19)12(16-14)8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H,18,19)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.83E+5n/an/an/an/an/an/a



Università di Padova

Curated by ChEMBL


Assay Description
Inhibition of [3H]-CHA binding to Adenosine A1 receptor in guinea pig heart


J Med Chem 39: 3671-83 (1996)


Article DOI: 10.1021/jm9508649
BindingDB Entry DOI: 10.7270/Q2HQ3Z07
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%