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BDBM203602 US9221809, 160

SMILES: Cc1cnc(C)c(n1)N1CCN(CC1)c1nc(N[C@@H]2CCCNC2)c(-c2nc3ccccc3s2)c(=O)[nH]1

InChI Key: InChIKey=QRXIVEJSNYRDQJ-LGWFVXIRNA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 203602   
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))
BDBM203602
PNG
(US9221809, 160)
Show SMILES Cc1cnc(C)c(n1)N1CCN(CC1)c1nc(N[C@@H]2CCCNC2)c(-c2nc3ccccc3s2)c(=O)[nH]1
Show InChI InChI=1/C26H31N9OS/c1-16-14-28-17(2)23(29-16)34-10-12-35(13-11-34)26-32-22(30-18-6-5-9-27-15-18)21(24(36)33-26)25-31-19-7-3-4-8-20(19)37-25/h3-4,7-8,14,18,27H,5-6,9-13,15H2,1-2H3,(H2,30,32,33,36)/t18-/s2
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MMDB

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PC cid
PC sid
UniChem
US Patent
n/an/a 22n/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