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BDBM50276119 CHEMBL513727::N-(3-benzyl-5-phenyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl)-4-chloro-2-nitrobenzamide

SMILES: [O-][N+](=O)c1cc(Cl)ccc1C(=O)Nc1nc(nc2n(Cc3ccccc3)nnc12)-c1ccccc1

InChI Key: InChIKey=WHFANIIIOIBVGA-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50276119   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Adenosine receptor A1


(Rattus norvegicus (rat))		BDBM50276119
PNG
(CHEMBL513727 | N-(3-benzyl-5-phenyl-3H-[1,2,3]tria...)
Show SMILES [O-][N+](=O)c1cc(Cl)ccc1C(=O)Nc1nc(nc2n(Cc3ccccc3)nnc12)-c1ccccc1
Show InChI InChI=1S/C24H16ClN7O3/c25-17-11-12-18(19(13-17)32(34)35)24(33)28-22-20-23(27-21(26-22)16-9-5-2-6-10-16)31(30-29-20)14-15-7-3-1-4-8-15/h1-13H,14H2,(H,26,27,28,33)
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Similars
Article
PubMed
 2.14E+3n/an/an/an/an/an/an/an/a



Università di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from adenosine A1 receptor in Wistar rat brain cortex by liquid scintillation counting

Bioorg Med Chem 17: 1817-30 (2009)


Article DOI: 10.1016/j.bmc.2009.01.060
BindingDB Entry DOI: 10.7270/Q2JD4WPZ
More data for this
Ligand-Target Pair