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SMILES: COc1cccc(NC(=O)c2cc(cnc2NCc2ccc(cc2)-c2cnc3[nH]nc(N)c3c2)C(F)(F)F)c1

InChI Key: InChIKey=IIPPARZKWKDLJC-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 282421   
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 [51-359]


(Homo sapiens (Human))		BDBM282421
PNG
(2-(4-(3-amino-1H-pyrazolo [3,4-b]pyridin-5-yl) ben...)
Show SMILES COc1cccc(NC(=O)c2cc(cnc2NCc2ccc(cc2)-c2cnc3[nH]nc(N)c3c2)C(F)(F)F)c1
Show InChI InChI=1S/C27H22F3N7O2/c1-39-20-4-2-3-19(11-20)35-26(38)22-10-18(27(28,29)30)14-34-24(22)32-12-15-5-7-16(8-6-15)17-9-21-23(31)36-37-25(21)33-13-17/h2-11,13-14H,12H2,1H3,(H,32,34)(H,35,38)(H3,31,33,36,37)
PDB

UniProtKB/SwissProt

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)


BindingDB Entry DOI: 10.7270/Q2S46V16
More data for this
Ligand-Target Pair