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SMILES: FC(F)(F)c1ccc(Cn2cccc(C(=O)NCc3cccc(c3)-c3c[nH]c4ncccc34)c2=O)cc1

InChI Key: InChIKey=PIZBTUOBUOGFKF-UHFFFAOYSA-N

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 366222   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
3-phosphoinositide-dependent protein kinase 1 [51-360]


(Homo sapiens (Human))		BDBM366222
PNG
(US9873693, Compound 145)
Show SMILES FC(F)(F)c1ccc(Cn2cccc(C(=O)NCc3cccc(c3)-c3c[nH]c4ncccc34)c2=O)cc1
Show InChI InChI=1S/C28H21F3N4O2/c29-28(30,31)21-10-8-18(9-11-21)17-35-13-3-7-23(27(35)37)26(36)34-15-19-4-1-5-20(14-19)24-16-33-25-22(24)6-2-12-32-25/h1-14,16H,15,17H2,(H,32,33)(H,34,36)
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
n/an/a<500n/an/an/an/an/an/a



Duquesne University



Assay Description
A PDK1 kinase assay was performed as follows. PDK1 (amino acids 51-360) and AKT2 (amino acids 140-467 fused to PIFtide, amino acids EEQEMFRDFDYIADW) ...

J Med Chem 51: 68-76 (2008)


BindingDB Entry DOI: 10.7270/Q2H41TRT
More data for this
Ligand-Target Pair