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BDBM50436973 CHEMBL2402274

SMILES: OC(=O)c1cnc(N2CCN(CC2)C(=O)NS(=O)(=O)c2ccccc2)c(Cl)c1

InChI Key: InChIKey=NBNKMSXTXJETQO-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50436973   
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
Purinergic receptor P2Y12


(Homo sapiens (Human))
BDBM50436973
PNG
(CHEMBL2402274)
Show SMILES OC(=O)c1cnc(N2CCN(CC2)C(=O)NS(=O)(=O)c2ccccc2)c(Cl)c1
Show InChI InChI=1S/C17H17ClN4O5S/c18-14-10-12(16(23)24)11-19-15(14)21-6-8-22(9-7-21)17(25)20-28(26,27)13-4-2-1-3-5-13/h1-5,10-11H,6-9H2,(H,20,25)(H,23,24)
PDB

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PC sid
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Similars

Article
PubMed
n/an/a>3.30E+4n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Displacement of [125I]-AZ11931285 from P2Y12 receptor (unknown origin) after 1 hr by scintillation counting analysis


Eur J Med Chem 65: 360-75 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.007
BindingDB Entry DOI: 10.7270/Q2PK0HJ2
More data for this
Ligand-Target Pair