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BDBM317249 US9617282, Example 18

SMILES: O=C(NCCN1CCCCC1)c1ccc2OCCCCCNc3cc(ccn3)-c3nc(cs3)C(=O)Nc2c1

InChI Key: InChIKey=JVMUSZKFLRWONK-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 317249   
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
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM317249
PNG
(US9617282, Example 18)
Show SMILES O=C(NCCN1CCCCC1)c1ccc2OCCCCCNc3cc(ccn3)-c3nc(cs3)C(=O)Nc2c1
Show InChI InChI=1S/C28H34N6O3S/c35-26(31-12-15-34-13-4-2-5-14-34)20-7-8-24-22(17-20)32-27(36)23-19-38-28(33-23)21-9-11-30-25(18-21)29-10-3-1-6-16-37-24/h7-9,11,17-19H,1-6,10,12-16H2,(H,29,30)(H,31,35)(H,32,36)
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US Patent
n/an/a<100n/an/an/an/an/an/a



BIOGEN MA INC.

US Patent


Assay Description
The biochemical assay is in a AlphaScreen format. The kinase reaction is based on the IRAK-4 phosphorylation of a biotin labeled peptide. The phospho...


US Patent US9617282 (2017)


BindingDB Entry DOI: 10.7270/Q2445PJK
More data for this
Ligand-Target Pair