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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adenosine receptor A3' and Ligand = 'BDBM50368909'   
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 A3


(Rattus norvegicus)		BDBM50368909
PNG
(CHEMBL607784)
Show SMILES CCCCCn1c2ncn(C3O[C@@H]([C@@H](O)[C@H]3O)C(=O)NC)c2c(=O)n(CCCCC)c1=O |r|
Show InChI InChI=1S/C21H33N5O6/c1-4-6-8-10-24-17-13(19(30)25(21(24)31)11-9-7-5-2)26(12-23-17)20-15(28)14(27)16(32-20)18(29)22-3/h12,14-16,20,27-28H,4-11H2,1-3H3,(H,22,29)/t14-,15+,16-,20?/m0/s1
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Similars
PubMed
 2.63E+3n/an/an/an/an/an/an/an/a



National Institute of Diabetes

Curated by ChEMBL


Assay Description
Displacement of specific [125]AB-MECA binding in membranes of CHO cells stably transfected with the rat A3-cDNA

J Med Chem 37: 4020-30 (1994)


BindingDB Entry DOI: 10.7270/Q2251JTQ
More data for this
Ligand-Target Pair