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BDBM340388 US9758538, Example 76

SMILES: CN1CCC(N2CC[C@@](CO)(C2)Nc2cc(nc(n2)N2CCOCC2)-c2cnc(N)nc2)C1=O

InChI Key: InChIKey=FZPFBJHZJPOVEN-UGNFMNBCSA-N

Data: 1 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 1 hit for monomerid = 340388   
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 regulatory subunit alpha


(Homo sapiens (Human))
BDBM340388
PNG
(US9758538, Example 76)
Show SMILES CN1CCC(N2CC[C@@](CO)(C2)Nc2cc(nc(n2)N2CCOCC2)-c2cnc(N)nc2)C1=O
Show InChI InChI=1S/C22H31N9O3/c1-29-4-2-17(19(29)33)31-5-3-22(13-31,14-32)28-18-10-16(15-11-24-20(23)25-12-15)26-21(27-18)30-6-8-34-9-7-30/h10-12,17,32H,2-9,13-14H2,1H3,(H2,23,24,25)(H,26,27,28)/t17?,22-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
1.82n/an/an/an/an/an/an/an/a



PFIZER INC.

US Patent


Assay Description
The biochemical assays of kinase activity of full-length PI3Kα (full-length p110α/p85α) or truncated PI3Kα (p110α/iSH2 p85&#...


US Patent US9758538 (2017)

More data for this
Ligand-Target Pair