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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adenosine receptor A1' and Ligand = 'BDBM50493151'   
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))		BDBM50493151
PNG
(CHEMBL2419139)
Show SMILES CCn1c(\N=C\c2ccc(Br)cc2)c(sc1=S)C#N
Show InChI InChI=1S/C13H10BrN3S2/c1-2-17-12(11(7-15)19-13(17)18)16-8-9-3-5-10(14)6-4-9/h3-6,8H,2H2,1H3/b16-8+
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PC cid
PC sid
UniChem
Article
PubMed
 0.000740n/an/an/an/an/an/an/an/a



University of Delhi

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human A1 receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting

Bioorg Med Chem 21: 6077-83 (2013)


Article DOI: 10.1016/j.bmc.2013.07.005
BindingDB Entry DOI: 10.7270/Q2CC13NZ
More data for this
Ligand-Target Pair