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SMILES: Cc1cc2c(cccc2[nH]1)-c1nc2c(nc(nc2[nH]1)N1CCOCC1)N1CCOCC1

InChI Key: InChIKey=RUNAXPMSDKPKIK-UHFFFAOYSA-N

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 151018   
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 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))		BDBM151018
PNG
(US8987257, 31)
Show SMILES Cc1cc2c(cccc2[nH]1)-c1nc2c(nc(nc2[nH]1)N1CCOCC1)N1CCOCC1
Show InChI InChI=1S/C22H25N7O2/c1-14-13-16-15(3-2-4-17(16)23-14)19-24-18-20(25-19)26-22(29-7-11-31-12-8-29)27-21(18)28-5-9-30-10-6-28/h2-4,13,23H,5-12H2,1H3,(H,24,25,26,27)
PDB
MMDB

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PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 590n/an/an/an/a7.54



Novartis AG

US Patent


Assay Description
PI3K KinaseGlo assay: 50 mL of compound dilutions were dispensed onto black 384-well low volume Non Binding Styrene (NBS) plates (Costar Cat. No. NBS...

US Patent US8987257 (2015)


BindingDB Entry DOI: 10.7270/Q2S75F2B
More data for this
Ligand-Target Pair