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SMILES: CC(=O)Nc1cc(cn2nccc12)-c1ccnc(Nc2ccnc(n2)C2CC2)c1

InChI Key: InChIKey=YFRHWKGGNQRORI-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 338190   
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 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM338190
PNG
(US9751854, Compound I-371)
Show SMILES CC(=O)Nc1cc(cn2nccc12)-c1ccnc(Nc2ccnc(n2)C2CC2)c1
Show InChI InChI=1S/C21H19N7O/c1-13(29)25-17-10-16(12-28-18(17)5-9-24-28)15-4-7-22-20(11-15)26-19-6-8-23-21(27-19)14-2-3-14/h4-12,14H,2-3H2,1H3,(H,25,29)(H,22,23,26,27)
PDB
MMDB

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PC cid
PC sid
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US Patent
n/an/a<10n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

US Patent


Assay Description
100 nL compounds in DMSO are added to wells of a 384 well microtitre plate (Greiner 780076). At room temperature: 5 ul VPS34 reaction buffer (Invitro...


US Patent US9751854 (2017)


BindingDB Entry DOI: 10.7270/Q2KS6TNJ
More data for this
Ligand-Target Pair