BindingDB logo
myBDB logout

BDBM317399 US9617282, Example 174

SMILES: CC(C)N1CCCc2cc(ccn2)-c2nc(cs2)C(=O)Nc2cn(nc2C(=O)NCC1)C1CCOCC1

InChI Key: InChIKey=MPUMOLXMRFXXRS-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 317399   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM317399
PNG
(US9617282, Example 174)
Show SMILES CC(C)N1CCCc2cc(ccn2)-c2nc(cs2)C(=O)Nc2cn(nc2C(=O)NCC1)C1CCOCC1
Show InChI InChI=1S/C26H33N7O3S/c1-17(2)32-10-3-4-19-14-18(5-8-27-19)26-30-22(16-37-26)24(34)29-21-15-33(20-6-12-36-13-7-20)31-23(21)25(35)28-9-11-32/h5,8,14-17,20H,3-4,6-7,9-13H2,1-2H3,(H,28,35)(H,29,34)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
PC cid
PC sid
UniChem
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