BindingDB logo
myBDB logout

PubMed code 12723950

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 receptor A1


(Homo sapiens (Human))
BDBM50127510
PNG
(CHEMBL54461 | [2-Amino-5-bromo-4-(3-trifluoromethy...)
Show SMILES Nc1sc(Br)c(c1C(=O)c1ccccc1)-c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C18H11BrF3NOS/c19-16-13(11-7-4-8-12(9-11)18(20,21)22)14(17(23)25-16)15(24)10-5-2-1-3-6-10/h1-9H,23H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 6.36E+3n/an/an/an/a



Deakin University

Curated by ChEMBL


Assay Description
Effective dose as dissociation of [3H]-N6-cyclohexyladenosine ([3H]-CHA) from CHO-K1 membrane after treatment with allosteric enhancer and (R)-PIA


J Med Chem 46: 1870-7 (2003)


Article DOI: 10.1021/jm020295m
BindingDB Entry DOI: 10.7270/Q2FJ2G5Z
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))
BDBM50080550
PNG
((2-Amino-4,5-dimethyl-thiophen-3-yl)-(3-trifluorom...)
Show SMILES Cc1sc(N)c(C(=O)c2cccc(c2)C(F)(F)F)c1C
Show InChI InChI=1S/C14H12F3NOS/c1-7-8(2)20-13(18)11(7)12(19)9-4-3-5-10(6-9)14(15,16)17/h3-6H,18H2,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/an/an/a 8.40E+3n/an/an/an/a



Deakin University

Curated by ChEMBL


Assay Description
Effective dose as dissociation of [3H]-N6-cyclohexyladenosine ([3H]-CHA) from CHO-K1 membrane after treatment with allosteric enhancer and (R)-PIA


J Med Chem 46: 1870-7 (2003)


Article DOI: 10.1021/jm020295m
BindingDB Entry DOI: 10.7270/Q2FJ2G5Z
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%