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BDBM178337 US9120812, 122

SMILES: CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccn(C)n4)cc3)c2C1=O)N1CC2CCC(C1)O2

InChI Key: InChIKey=XNQKOQIAMIRTRL-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 178337   
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
PI3-kinase class I


(Homo sapiens (Human))
BDBM178337
PNG
(US9120812, 122)
Show SMILES CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccn(C)n4)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:32:35.36:39|
Show InChI InChI=1S/C28H34N8O4/c1-5-35-16-28(2,3)40-24-22(25(35)37)23(31-26(32-24)36-14-19-10-11-20(15-36)39-19)17-6-8-18(9-7-17)29-27(38)30-21-12-13-34(4)33-21/h6-9,12-13,19-20H,5,10-11,14-16H2,1-4H3,(H2,29,30,33,38)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 4.20E+3n/an/an/an/a7.5n/a



Sanofi

US Patent


Assay Description
The test uses a lucifeurerin/luciferase system to measure the concentration of ATP and its consumption during the enzymatic reaction. The test is per...


US Patent US9120812 (2015)


BindingDB Entry DOI: 10.7270/Q2KH0M2D
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (Human))
BDBM178337
PNG
(US9120812, 122)
Show SMILES CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccn(C)n4)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:32:35.36:39|
Show InChI InChI=1S/C28H34N8O4/c1-5-35-16-28(2,3)40-24-22(25(35)37)23(31-26(32-24)36-14-19-10-11-20(15-36)39-19)17-6-8-18(9-7-17)29-27(38)30-21-12-13-34(4)33-21/h6-9,12-13,19-20H,5,10-11,14-16H2,1-4H3,(H2,29,30,33,38)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 19n/an/an/an/a7.525



Sanofi

US Patent


Assay Description
The test detects the phosphorylation of the substrate GFP-4EBP1 using a terbium-labelled antibody that is specific for the phospho-Thr46 epitope. Bin...


US Patent US9120812 (2015)


BindingDB Entry DOI: 10.7270/Q2KH0M2D
More data for this
Ligand-Target Pair