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BDBM181487 US9139577, 3.048::US9708274, 3.048

SMILES: Cc1cc(cc2ncnc(Nc3ccc(F)cc3OCC3CCOC3)c12)N=S(C)(C)=O

InChI Key: InChIKey=TWSKBRHSGAZKLV-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 181487   
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
MAP kinase-interacting serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM181487
PNG
(US9139577, 3.048 | US9708274, 3.048)
Show SMILES Cc1cc(cc2ncnc(Nc3ccc(F)cc3OCC3CCOC3)c12)N=S(C)(C)=O
Show InChI InChI=1S/C22H25FN4O3S/c1-14-8-17(27-31(2,3)28)10-19-21(14)22(25-13-24-19)26-18-5-4-16(23)9-20(18)30-12-15-6-7-29-11-15/h4-5,8-10,13,15H,6-7,11-12H2,1-3H3,(H,24,25,26)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 11n/an/an/an/an/a25



EVOTEC INTERNATIONAL GMBH

US Patent


Assay Description
The inhibition of kinase activity of MNK2a was assessed using pre-activated GST-MNK2a. The white, 384-well OptiPlate F plates were purchased from Per...


US Patent US9708274 (2017)


BindingDB Entry DOI: 10.7270/Q2VX0JJG
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM181487
PNG
(US9139577, 3.048 | US9708274, 3.048)
Show SMILES Cc1cc(cc2ncnc(Nc3ccc(F)cc3OCC3CCOC3)c12)N=S(C)(C)=O
Show InChI InChI=1S/C22H25FN4O3S/c1-14-8-17(27-31(2,3)28)10-19-21(14)22(25-13-24-19)26-18-5-4-16(23)9-20(18)30-12-15-6-7-29-11-15/h4-5,8-10,13,15H,6-7,11-12H2,1-3H3,(H,24,25,26)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 11n/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The inhibition of kinase activity of MNK2a was assessed using pre-activated GST-MNK2a. The white, 384-well OptiPlate F plates were purchased from Per...


US Patent US9139577 (2015)


BindingDB Entry DOI: 10.7270/Q2K64GT1
More data for this
Ligand-Target Pair