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BDBM340416 US9758538, Example 104

SMILES: C[C@H]1COCCN1c1nc(N[C@@]2(CO)CCN(C2)C(=O)C2COC2)cc(n1)-c1cnc(N)nc1

InChI Key: InChIKey=MZGKKFZRPFABAE-FPTDNZKUSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 340416   
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))
BDBM340416
PNG
(US9758538, Example 104)
Show SMILES C[C@H]1COCCN1c1nc(N[C@@]2(CO)CCN(C2)C(=O)C2COC2)cc(n1)-c1cnc(N)nc1
Show InChI InChI=1S/C22H30N8O4/c1-14-9-33-5-4-30(14)21-26-17(15-7-24-20(23)25-8-15)6-18(27-21)28-22(13-31)2-3-29(12-22)19(32)16-10-34-11-16/h6-8,14,16,31H,2-5,9-13H2,1H3,(H2,23,24,25)(H,26,27,28)/t14-,22-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
0.674n/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