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BDBM203767 US9221809, 318

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

InChI Key: InChIKey=SDIUPLMCMHPNMY-UGPWUYPHNA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 203767   
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))
BDBM203767
PNG
(US9221809, 318)
Show SMILES NC(=O)N1CCN(CC1)c1nc(N[C@@H]2CCCNC2)c(-c2nc3ccccc3s2)c(=O)[nH]1
Show InChI InChI=1/C21H26N8O2S/c22-20(31)28-8-10-29(11-9-28)21-26-17(24-13-4-3-7-23-12-13)16(18(30)27-21)19-25-14-5-1-2-6-15(14)32-19/h1-2,5-6,13,23H,3-4,7-12H2,(H2,22,31)(H2,24,26,27,30)/t13-/s2
PDB
MMDB

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PC cid
PC sid
UniChem
US Patent
n/an/a 74n/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