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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Ribosomal protein S6 kinase beta-1' and Ligand = 'BDBM182408'   
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
Ribosomal protein S6 kinase beta-1


(Homo sapiens (Human))
BDBM182408
PNG
(US9145392, 109)
Show SMILES Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccc(F)c(c2)C(F)(F)F)c1-c1cnoc1
Show InChI InChI=1S/C27H28F4N8O/c28-21-3-2-18(12-20(21)27(29,30)31)22-14-39(11-10-37-6-1-7-37)25(36-22)17-4-8-38(9-5-17)26-23(19-13-35-40-15-19)24(32)33-16-34-26/h2-3,12-17H,1,4-11H2,(H2,32,33,34)
PDB
MMDB

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UniProtKB/SwissProt

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antibodypedia
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PC cid
PC sid
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Similars

US Patent
n/an/a 0.900n/an/an/an/a7.525



Merck Patent GmbH

US Patent


Assay Description
P70S6K inhibitor compounds are diluted and plated in 96 well plates. A reaction mixture including the following components is then added to the compo...


US Patent US9145392 (2015)


BindingDB Entry DOI: 10.7270/Q2NZ86D2
More data for this
Ligand-Target Pair