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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 = 'BDBM50515210'   
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))
BDBM50515210
PNG
(CHEMBL4568077)
Show SMILES C[C@H]1COCCN1c1nc(cc(n1)-c1cnc(N)cc1C(F)F)N1CCOCC1 |r|
Show InChI InChI=1S/C19H24F2N6O2/c1-12-11-29-7-4-27(12)19-24-15(9-17(25-19)26-2-5-28-6-3-26)14-10-23-16(22)8-13(14)18(20)21/h8-10,12,18H,2-7,11H2,1H3,(H2,22,23)/t12-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
10n/an/an/an/an/an/an/an/a



University of Basel

Curated by ChEMBL


Assay Description
Displacement of Alexafluor labelled kinase tracer314 from recombinant human C-terminal GST-tagged mTOR (1360 to 2549 amino acids) expressed in insect...


J Med Chem 62: 6241-6261 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00525
BindingDB Entry DOI: 10.7270/Q29G5R5G
More data for this
Ligand-Target Pair