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PubMed code 1654429

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


(Homo sapiens (human)-Homo sapiens (Human))
BDBM50229540
PNG
(CHEMBL2112109)
Show SMILES Nc1ncnc2n(cnc12)[C@H]1CN[C@@H](CO)C1
Show InChI InChI=1S/C10H14N6O/c11-9-8-10(14-4-13-9)16(5-15-8)7-1-6(3-17)12-2-7/h4-7,12,17H,1-3H2,(H2,11,13,14)/t6-,7-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
4.25E+4n/an/an/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Binding affinity towards adenosine receptor


J Med Chem 34: 2787-97 (1991)


Article DOI: 10.1021/jm00113a017
BindingDB Entry DOI: 10.7270/Q24F1PPZ
More data for this
Ligand-Target Pair
Adenosine deaminase


(Homo sapiens (human))
BDBM50007213
PNG
(CHEMBL96772 | [5-(6-Amino-purin-9-yl)-oxazolidin-2...)
Show SMILES Nc1ncnc2n(cnc12)C1CNC(CO)O1
Show InChI InChI=1S/C9H12N6O2/c10-8-7-9(13-3-12-8)15(4-14-7)6-1-11-5(2-16)17-6/h3-6,11,16H,1-2H2,(H2,10,12,13)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
8.50E+4n/an/an/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
The compound was tested for binding affinity towards adenosine deaminase


J Med Chem 34: 2787-97 (1991)


Article DOI: 10.1021/jm00113a017
BindingDB Entry DOI: 10.7270/Q24F1PPZ
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%