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SMILES: CCOc1nn2c(cc1CC)nn(CC(=O)c1cc(N3CCOCC3)c(OC)c(c1)C(C)(C)C)c2=N

InChI Key: InChIKey=GIGUNLQHLPMKBH-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 169635   
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 1


(Homo sapiens (Human))		BDBM169635
PNG
(US9079906, 144)
Show SMILES CCOc1nn2c(cc1CC)nn(CC(=O)c1cc(N3CCOCC3)c(OC)c(c1)C(C)(C)C)c2=N
Show InChI InChI=1S/C26H36N6O4/c1-7-17-15-22-28-31(25(27)32(22)29-24(17)36-8-2)16-21(33)18-13-19(26(3,4)5)23(34-6)20(14-18)30-9-11-35-12-10-30/h13-15,27H,7-12,16H2,1-6H3
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Similars
US Patent
n/an/a 827n/an/an/an/a7.525



Sanofi

US Patent


Assay Description
The synthesized substances were examined in a PAR1 binding test. This tested whether the substances can inhibit the binding of a radioactively labele...

US Patent US9079906 (2015)


BindingDB Entry DOI: 10.7270/Q2251GZP
More data for this
Ligand-Target Pair