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SMILES: CC(=O)Nc1ccc2nc(nc(N3CCOCC3)c2c1)-c1cccc(NS(=O)(=O)c2ccc3ccccc3c2)c1

InChI Key: InChIKey=FFNCFGWKXFOXPA-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50197066   
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
Phosphatidylinositol 4-phosphate 3-kinase C2 domain-containing subunit beta


(Homo sapiens (Human))		BDBM50197066
PNG
(CHEMBL3903959)
Show SMILES CC(=O)Nc1ccc2nc(nc(N3CCOCC3)c2c1)-c1cccc(NS(=O)(=O)c2ccc3ccccc3c2)c1
Show InChI InChI=1S/C30H27N5O4S/c1-20(36)31-24-10-12-28-27(19-24)30(35-13-15-39-16-14-35)33-29(32-28)23-7-4-8-25(17-23)34-40(37,38)26-11-9-21-5-2-3-6-22(21)18-26/h2-12,17-19,34H,13-16H2,1H3,(H,31,36)
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Curtin University

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged human recombinant PI3KC2beta expressed in Sf9 cells

J Med Chem 60: 47-65 (2017)


Article DOI: 10.1021/acs.jmedchem.6b00963
BindingDB Entry DOI: 10.7270/Q2PG1TPX
More data for this
Ligand-Target Pair