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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 = 'BDBM50368920'   
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)		BDBM50368920
PNG
(CHEMBL610095)
Show SMILES CCCCCn1c2ncn(C3O[C@H](CO)[C@@H](O)[C@H]3O)c2c(=O)n(CCCCC)c1=O |r|
Show InChI InChI=1S/C20H32N4O6/c1-3-5-7-9-22-17-14(18(28)23(20(22)29)10-8-6-4-2)24(12-21-17)19-16(27)15(26)13(11-25)30-19/h12-13,15-16,19,25-27H,3-11H2,1-2H3/t13-,15-,16-,19?/m1/s1
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PC sid
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Similars
PubMed
 4.81E+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