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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Serine/threonine-protein kinase mTOR' and Ligand = 'BDBM50315462'   
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
Serine/threonine-protein kinase mTOR


(Homo sapiens (Human))
BDBM50315462
PNG
(4,6-dihydroxy-2-((5-methoxy-2-methyl-1-(2-morpholi...)
Show SMILES COc1ccc2n(CCN3CCOCC3)c(C)c(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
Show InChI InChI=1S/C25H26N2O6/c1-15-18(14-23-25(30)24-21(29)11-16(28)12-22(24)33-23)19-13-17(31-2)3-4-20(19)27(15)6-5-26-7-9-32-10-8-26/h3-4,11-14,28-29H,5-10H2,1-2H3/b23-14-
PDB
MMDB

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Similars

Article
PubMed
n/an/a 9n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of mTOR


Bioorg Med Chem Lett 20: 2586-90 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.082
BindingDB Entry DOI: 10.7270/Q2FQ9WRX
More data for this
Ligand-Target Pair