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BDBM187792 US9169252, 340

SMILES: CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1COC1)-n1cnc2cc(Cl)cnc12

InChI Key: InChIKey=MVWHQECEJRYEAB-XISACWJONA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 187792   
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))
BDBM187792
PNG
(US9169252, 340)
Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1NC1COC1)-n1cnc2cc(Cl)cnc12
Show InChI InChI=1/C20H22ClFN6O3/c1-20(2,30)16(22)7-25-19(29)13-6-23-17(4-14(13)27-12-8-31-9-12)28-10-26-15-3-11(21)5-24-18(15)28/h3-6,10,12,16,30H,7-9H2,1-2H3,(H,23,27)(H,25,29)/t16-/s2
PDB
MMDB

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PC cid
PC sid
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Similars

US Patent
n/an/a 10n/an/an/an/a7.2n/a



Bristol-Myers Squibb Co.

US Patent


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


US Patent US9169252 (2015)


BindingDB Entry DOI: 10.7270/Q2MP5235
More data for this
Ligand-Target Pair