BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adenosine receptor A1' and Ligand = 'BDBM50292320'   
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))		BDBM50292320
PNG
(CHEMBL400746 | N-(4-(9-((2R,3R,4S,5R)-3,4-dihydrox...)
Show SMILES CC1(C)N([O])C(C)(C)c2cc(ccc12)C(=O)NCCc1ccc(Nc2ncnc3n(cnc23)[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1 |^1:4|
Show InChI InChI=1S/C31H36N7O6/c1-30(2)20-10-7-18(13-21(20)31(3,4)38(30)43)28(42)32-12-11-17-5-8-19(9-6-17)36-26-23-27(34-15-33-26)37(16-35-23)29-25(41)24(40)22(14-39)44-29/h5-10,13,15-16,22,24-25,29,39-41H,11-12,14H2,1-4H3,(H,32,42)(H,33,34,36)/t22-,24-,25-,29-/m1/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
 7n/an/an/an/an/an/an/an/a



Monash University (Parkville Campus)

Curated by ChEMBL


Assay Description
Binding affinity to adenosine A1 receptor

Bioorg Med Chem Lett 17: 5437-41 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.035
BindingDB Entry DOI: 10.7270/Q2VX0G7M
More data for this
Ligand-Target Pair