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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 = 'BDBM50305298'   
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))
BDBM50305298
PNG
(5-(9-(1-((6-fluoropyridin-3-yl)methyl)piperidin-4-...)
Show SMILES Oc1cncc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCN(Cc4ccc(F)nc4)CC3)c2n1
Show InChI InChI=1S/C25H27FN8O2/c26-21-2-1-17(12-28-21)15-32-5-3-19(4-6-32)34-16-29-22-24(33-7-9-36-10-8-33)30-23(31-25(22)34)18-11-20(35)14-27-13-18/h1-2,11-14,16,19,35H,3-10,15H2
PDB
MMDB

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 570n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of mTOR


Bioorg Med Chem Lett 20: 653-6 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.057
BindingDB Entry DOI: 10.7270/Q2X63N1H
More data for this
Ligand-Target Pair