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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '3-phosphoinositide-dependent protein kinase 1 (51-359)' and Ligand = 'BDBM281806'   
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
3-phosphoinositide-dependent protein kinase 1 (51-359)


(Homo sapiens (Human))
BDBM281806
PNG
((S)-5-cyano-N-(1-(4-fluorophenyl) ethyl)-2-(((5-(1...)
Show SMILES C[C@H](NC(=O)c1cc(cnc1NCc1ccc(s1)-c1ccc2ncc3ncn(C)c3c2c1)C#N)c1ccc(F)cc1
Show InChI InChI=1S/C31H24FN7OS/c1-18(20-3-6-22(32)7-4-20)38-31(40)25-11-19(13-33)14-35-30(25)36-15-23-8-10-28(41-23)21-5-9-26-24(12-21)29-27(16-34-26)37-17-39(29)2/h3-12,14,16-18H,15H2,1-2H3,(H,35,36)(H,38,40)/t18-/m0/s1
PDB

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



Sunesis Pharmaceuticals, Inc.; Millenium Pharmaceuticals, Inc.

US Patent


Assay Description
PDK1 (amino acids 51-359) and AKT2 (amino acids 140-467 fused to PIFtide, amino acids EEQEMFRDFDYIADW) were expressed as N-terminally tagged GST fusi...


US Patent US10030016 (2018)

More data for this
Ligand-Target Pair