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BDBM50412716 AC-98170::CHEMBL494303

SMILES: CC(=NNC(=O)[C@H]1[C@@H](CNC1=O)c1ccccc1)c1cccs1

InChI Key: InChIKey=GNFXCDMTRHENBV-ZFWWWQNUSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50412716   
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
Proteinase-activated receptor 2


(Homo sapiens (Human))
BDBM50412716
PNG
(AC-98170 | CHEMBL494303)
Show SMILES CC(=NNC(=O)[C@H]1[C@@H](CNC1=O)c1ccccc1)c1cccs1 |r,w:2.2|
Show InChI InChI=1S/C17H17N3O2S/c1-11(14-8-5-9-23-14)19-20-17(22)15-13(10-18-16(15)21)12-6-3-2-4-7-12/h2-9,13,15H,10H2,1H3,(H,18,21)(H,20,22)/t13-,15-/m0/s1
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Article
PubMed
n/an/an/an/a 6.31E+3n/an/an/an/a



ACADIA Pharmaceuticals AB

Curated by ChEMBL


Assay Description
Agonist activity at human PAR2 expressed in HEK293T cells assessed as effect on intracellular calcium mobilization by R-SAT assay


J Med Chem 51: 5490-3 (2008)


Article DOI: 10.1021/jm800754r
BindingDB Entry DOI: 10.7270/Q290251P
More data for this
Ligand-Target Pair