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BDBM259282 US9499547, 23

SMILES: N[C@@H]1CCCC[C@H]1Oc1ccc2ncc(-c3cc4ccccc4o3)n2n1

InChI Key: InChIKey=QLRAZPPSOATMKB-RHSMWYFYSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 259282   
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
GST-MAP kinase-interacting serine/threonine-protein kinase 1 (MKNK1) (T344D)


(Homo sapiens (Human))
BDBM259282
PNG
(US9499547, 23)
Show SMILES N[C@@H]1CCCC[C@H]1Oc1ccc2ncc(-c3cc4ccccc4o3)n2n1 |r|
Show InChI InChI=1S/C20H20N4O2/c21-14-6-2-4-8-17(14)26-20-10-9-19-22-12-15(24(19)23-20)18-11-13-5-1-3-7-16(13)25-18/h1,3,5,7,9-12,14,17H,2,4,6,8,21H2/t14-,17-/m1/s1
PDB
MMDB

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PC cid
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US Patent
n/an/a 18n/an/an/an/a7.522



BAYER INTELLECTUAL PROPERTY GMBH

US Patent


Assay Description
MKNK1-inhibitory activity at high ATP of compounds of the present invention after their preincubation with MKNK1 was quantified employing the TR-FRET...


US Patent US9499547 (2016)


BindingDB Entry DOI: 10.7270/Q2736PVK
More data for this
Ligand-Target Pair