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BDBM187535 US9169252, 119

SMILES: C[C@@H](CF)Nc1cc(ncc1C(=O)NCCC(C)(C)O)-n1ccc2cc(cnc12)C#N

InChI Key: InChIKey=URVKIIFNZONLPP-YQTOOIBONA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 187535   
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))
BDBM187535
PNG
(US9169252, 119)
Show SMILES C[C@@H](CF)Nc1cc(ncc1C(=O)NCCC(C)(C)O)-n1ccc2cc(cnc12)C#N
Show InChI InChI=1/C22H25FN6O2/c1-14(10-23)28-18-9-19(26-13-17(18)21(30)25-6-5-22(2,3)31)29-7-4-16-8-15(11-24)12-27-20(16)29/h4,7-9,12-14,31H,5-6,10H2,1-3H3,(H,25,30)(H,26,28)/t14-/s2
PDB
MMDB

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PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 4.40n/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