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BDBM281767 2-(3-(1H-pyrrolo[2,3-b]pyridin- 3-yl)benzylamino)-N-(4- fluorobenzyl)nicotinamide::US10030016, Example 1.6

SMILES: Fc1ccc(CNC(=O)c2cccnc2NCc2cccc(c2)-c2c[nH]c3ncccc23)cc1

InChI Key: InChIKey=LZRXHNBORXWYRR-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 281767   
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))
BDBM281767
PNG
(2-(3-(1H-pyrrolo[2,3-b]pyridin- 3-yl)benzylamino)-...)
Show SMILES Fc1ccc(CNC(=O)c2cccnc2NCc2cccc(c2)-c2c[nH]c3ncccc23)cc1
Show InChI InChI=1S/C27H22FN5O/c28-21-10-8-18(9-11-21)15-33-27(34)23-7-3-13-30-26(23)31-16-19-4-1-5-20(14-19)24-17-32-25-22(24)6-2-12-29-25/h1-14,17H,15-16H2,(H,29,32)(H,30,31)(H,33,34)
PDB

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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