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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Target of rapamycin complex 2 subunit MAPKAP1' and Ligand = 'BDBM50505422'   
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
Target of rapamycin complex 2 subunit MAPKAP1


(Homo sapiens)
BDBM50505422
PNG
(CHEMBL4562100)
Show SMILES [H][C@]12Cc3c(nc(nc3N3CCOCC3(C)C)-c3ccc(N)nc3)N1CCOC2 |r|
Show InChI InChI=1S/C20H26N6O2/c1-20(2)12-28-8-6-26(20)19-15-9-14-11-27-7-5-25(14)18(15)23-17(24-19)13-3-4-16(21)22-10-13/h3-4,10,14H,5-9,11-12H2,1-2H3,(H2,21,22)/t14-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 409n/an/an/an/an/an/a



University of Basel

Curated by ChEMBL


Assay Description
Inhibition of mTORC2 in human A2058 cells assessed as reduction in PKB phosphorylation at S473 residues incubated for 1 hr by Western blot analysis


J Med Chem 62: 8609-8630 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00972
BindingDB Entry DOI: 10.7270/Q2DJ5JW1
More data for this
Ligand-Target Pair