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BDBM209938 US9546153, ex. 206

SMILES: CC(C)NC(=O)N[C@H]1CC[C@@H](CC1)NC(=O)c1cnc(Nc2ccc3ncsc3c2)cc1NC(C)C

InChI Key: InChIKey=MZFJZTDEFNJXPP-IYARVYRRSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 209938   
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))
BDBM209938
PNG
(US9546153, ex. 206)
Show SMILES CC(C)NC(=O)N[C@H]1CC[C@@H](CC1)NC(=O)c1cnc(Nc2ccc3ncsc3c2)cc1NC(C)C
Show InChI InChI=1S/C26H35N7O2S/c1-15(2)29-22-12-24(31-19-9-10-21-23(11-19)36-14-28-21)27-13-20(22)25(34)32-17-5-7-18(8-6-17)33-26(35)30-16(3)4/h9-18H,5-8H2,1-4H3,(H,32,34)(H2,27,29,31)(H2,30,33,35)/t17-,18-
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PC cid
PC sid
UniChem
US Patent
n/an/a 2.10n/an/an/an/a7.225



Bristol-Myers Squibb Co.

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μL prepared from 15 μL additions of enzyme and substra...


US Patent US9546153 (2017)


BindingDB Entry DOI: 10.7270/Q28C9Z71
More data for this
Ligand-Target Pair