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BDBM203724 US9221809, 275

SMILES: O=c1[nH]c(nc(NC2CNC2)c1-c1ccc2ccccc2n1)N1CCOCC1

InChI Key: InChIKey=ONSAJXRZYRRXOW-UHFFFAOYSA-N

Data: 1 IC50

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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 = 203724   
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))
BDBM203724
PNG
(US9221809, 275)
Show SMILES O=c1[nH]c(nc(NC2CNC2)c1-c1ccc2ccccc2n1)N1CCOCC1
Show InChI InChI=1S/C20H22N6O2/c27-19-17(16-6-5-13-3-1-2-4-15(13)23-16)18(22-14-11-21-12-14)24-20(25-19)26-7-9-28-10-8-26/h1-6,14,21H,7-12H2,(H2,22,24,25,27)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
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PC cid
PC sid
UniChem
US Patent
n/an/a 150n/an/an/an/a7.225



Merck Sharp & Dohme Corp

US Patent


Assay Description
A 20 ul reaction mixture contains 10 mM TriHCl, pH 7.2, 0.5 nM GST tagged IRAK4 (SignalChem), 100 nM fluorescent peptide substrate (RP7030, Molecul...


US Patent US9221809 (2015)


BindingDB Entry DOI: 10.7270/Q23B5XZM
More data for this
Ligand-Target Pair