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BDBM207526 US9260439, 410::US9260439, 411

SMILES: CC[C@@]1(CCN(C1)C(=O)OC(C)(C)C)N1CCc2c1nc(nc2-c1cnc(N)nc1)N1CCOCC1

InChI Key: InChIKey=YMDPKBKTCCPXED-VWLOTQADSA-N

Data: 2 KI

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 = 207526   
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
p110alpha-iSH2 p85alpha Complex


(Homo sapiens (Human))
BDBM207526
PNG
(US9260439, 410 | US9260439, 411)
Show SMILES CC[C@@]1(CCN(C1)C(=O)OC(C)(C)C)N1CCc2c1nc(nc2-c1cnc(N)nc1)N1CCOCC1
Show InChI InChI=1S/C25H36N8O3/c1-5-25(7-9-32(16-25)23(34)36-24(2,3)4)33-8-6-18-19(17-14-27-21(26)28-15-17)29-22(30-20(18)33)31-10-12-35-13-11-31/h14-15H,5-13,16H2,1-4H3,(H2,26,27,28)/t25-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
<0.0180n/an/an/an/an/an/an/an/a



PFIZER INC.

US Patent


Assay Description
PI3KA_Act: Genes encoding for full length p110alpha and p85alpha nSH-iSH2=niSH2 (p85a aminoacids 322-600) subunits of PI3Kalpha complex were subclone...


US Patent US9260439 (2016)


BindingDB Entry DOI: 10.7270/Q2VH5MPV
More data for this
Ligand-Target Pair
p110alpha-iSH2 p85alpha Complex


(Homo sapiens (Human))
BDBM207526
PNG
(US9260439, 410 | US9260439, 411)
Show SMILES CC[C@@]1(CCN(C1)C(=O)OC(C)(C)C)N1CCc2c1nc(nc2-c1cnc(N)nc1)N1CCOCC1
Show InChI InChI=1S/C25H36N8O3/c1-5-25(7-9-32(16-25)23(34)36-24(2,3)4)33-8-6-18-19(17-14-27-21(26)28-15-17)29-22(30-20(18)33)31-10-12-35-13-11-31/h14-15H,5-13,16H2,1-4H3,(H2,26,27,28)/t25-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
0.262n/an/an/an/an/an/an/an/a



PFIZER INC.

US Patent


Assay Description
PI3KA_Act: Genes encoding for full length p110alpha and p85alpha nSH-iSH2=niSH2 (p85a aminoacids 322-600) subunits of PI3Kalpha complex were subclone...


US Patent US9260439 (2016)


BindingDB Entry DOI: 10.7270/Q2VH5MPV
More data for this
Ligand-Target Pair