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SMILES: Clc1ccc(s1)S(=O)(=O)NC1C2CCC1Cc1cc(OCCN3CCOCC3)ccc1C2

InChI Key: InChIKey=HLOHGSQIYIKVGL-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50157998   
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
Gamma-secretase subunit APH-1A/Gamma-secretase subunit APH-1B/Gamma-secretase subunit PEN-2/Nicastrin/Presenilin-1/Presenilin-2


(Homo sapiens (Human))		BDBM50157998
PNG
(5-Chloro-thiophene-2-sulfonic acid [5-(2-morpholin...)
Show SMILES Clc1ccc(s1)S(=O)(=O)NC1C2CCC1Cc1cc(OCCN3CCOCC3)ccc1C2 |THB:17:16:10:13.12,9:10:16.30.15.31:13.12,29:30:10:13.12|
Show InChI InChI=1S/C23H29ClN2O4S2/c24-21-5-6-22(31-21)32(27,28)25-23-17-1-2-18(23)14-19-15-20(4-3-16(19)13-17)30-12-9-26-7-10-29-11-8-26/h3-6,15,17-18,23,25H,1-2,7-14H2
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Article
PubMed
n/an/a 5n/an/an/an/an/an/a



Merck Sharp & Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Inhibitory concentration against Gamma-secretase in whole cell inhibition assay using SH-SY5Y cells

Bioorg Med Chem Lett 15: 373-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.10.062
BindingDB Entry DOI: 10.7270/Q2445KZQ
More data for this
Ligand-Target Pair