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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform [H1047R]' and Ligand = 'BDBM602671'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform [H1047R]


(Homo sapiens (Human))
BDBM602671
PNG
(2-[1-[2-(3- Azabicyclo[3.1.1]heptan-3-yl)- 6-methy...)
Show SMILES CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CC2CC(C2)C1 |(,-2.31,;-1.33,-1.54,;-2.67,-2.31,;-4,-1.54,;-4,,;-5.33,.77,;-6.67,,;-6.67,-1.54,;-5.33,-2.31,;-5.33,-3.85,;-6.67,-4.62,;-4,-4.62,;-1.33,,;-2.67,.77,;-2.67,2.31,;-4,3.08,;-1.33,3.08,;,2.31,;,.77,;1.33,,;2.67,.77,;2.67,2.31,;1.33,3.08,;1.33,4.62,;4,,;4,-1.54,;5.33,-2.31,;6.67,-1.54,;6.67,,;5.33,-.77,;5.33,.77,)|
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a<500n/an/an/an/an/an/a


TBA



Citation and Details

BindingDB Entry DOI: 10.7270/Q2N58RBV
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform [H1047R]


(Homo sapiens (Human))
BDBM602671
PNG
(2-[1-[2-(3- Azabicyclo[3.1.1]heptan-3-yl)- 6-methy...)
Show SMILES CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CC2CC(C2)C1 |(,-2.31,;-1.33,-1.54,;-2.67,-2.31,;-4,-1.54,;-4,,;-5.33,.77,;-6.67,,;-6.67,-1.54,;-5.33,-2.31,;-5.33,-3.85,;-6.67,-4.62,;-4,-4.62,;-1.33,,;-2.67,.77,;-2.67,2.31,;-4,3.08,;-1.33,3.08,;,2.31,;,.77,;1.33,,;2.67,.77,;2.67,2.31,;1.33,3.08,;1.33,4.62,;4,,;4,-1.54,;5.33,-2.31,;6.67,-1.54,;6.67,,;5.33,-.77,;5.33,.77,)|
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a<500n/an/an/an/an/an/a


TBA



Citation and Details

BindingDB Entry DOI: 10.7270/Q28K7F74
More data for this
Ligand-Target Pair