BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 404.4
BDBM385992

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 2 hits in this display   
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 [T412E]


(Homo sapiens (Human))
BDBM385992
PNG
(2-(1-(5,6,7,8-tetrahydro-1,8-naphthyridin-4-yl)pip...)
Show SMILES NCC(C1CCN(CC1)c1ccnc2NCCCc12)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C22H27F3N4/c23-22(24,25)17-5-3-15(4-6-17)19(14-26)16-8-12-29(13-9-16)20-7-11-28-21-18(20)2-1-10-27-21/h3-7,11,16,19H,1-2,8-10,12-14,26H2,(H,27,28)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 62n/an/an/an/an/an/a



University of Wisconsin at Madison



Assay Description
P70S6K inhibitor compounds were diluted and plated in 96 well plates. A reaction mixture including the following components was then added to the com...


J Med Chem 51: 7243-52 (2008)


BindingDB Entry DOI: 10.7270/Q26M394B
More data for this
Ligand-Target Pair
Proline-rich AKT1 substrate 1


(Homo sapiens (Human))
BDBM385992
PNG
(2-(1-(5,6,7,8-tetrahydro-1,8-naphthyridin-4-yl)pip...)
Show SMILES NCC(C1CCN(CC1)c1ccnc2NCCCc12)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C22H27F3N4/c23-22(24,25)17-5-3-15(4-6-17)19(14-26)16-8-12-29(13-9-16)20-7-11-28-21-18(20)2-1-10-27-21/h3-7,11,16,19H,1-2,8-10,12-14,26H2,(H,27,28)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 300n/an/an/an/an/an/a



University of Wisconsin at Madison



Assay Description
A TTP Mosquito liquid handling instrument was used to place 125 nl of the appropriate concentration of inhibitor in 100% DMSO (for a dose response cu...


J Med Chem 51: 7243-52 (2008)


BindingDB Entry DOI: 10.7270/Q26M394B
More data for this
Ligand-Target Pair