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BDBM181498 US9139577, 4.004::US9708274, 4.004

SMILES: C[C@@H](Oc1cc(F)ccc1Nc1ncnc2cc(cc(C)c12)N=S1(=O)CCCC1)C(=O)N1CCS(=O)CC1

InChI Key: InChIKey=LWKHKBUMAZQUQI-GOSISDBHSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 181498   
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))
BDBM181498
PNG
(US9139577, 4.004 | US9708274, 4.004)
Show SMILES C[C@@H](Oc1cc(F)ccc1Nc1ncnc2cc(cc(C)c12)N=S1(=O)CCCC1)C(=O)N1CCS(=O)CC1
Show InChI InChI=1S/C26H30FN5O4S2/c1-17-13-20(31-38(35)11-3-4-12-38)15-22-24(17)25(29-16-28-22)30-21-6-5-19(27)14-23(21)36-18(2)26(33)32-7-9-37(34)10-8-32/h5-6,13-16,18H,3-4,7-12H2,1-2H3,(H,28,29,30)/t18-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 6n/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))
BDBM181498
PNG
(US9139577, 4.004 | US9708274, 4.004)
Show SMILES C[C@@H](Oc1cc(F)ccc1Nc1ncnc2cc(cc(C)c12)N=S1(=O)CCCC1)C(=O)N1CCS(=O)CC1
Show InChI InChI=1S/C26H30FN5O4S2/c1-17-13-20(31-38(35)11-3-4-12-38)15-22-24(17)25(29-16-28-22)30-21-6-5-19(27)14-23(21)36-18(2)26(33)32-7-9-37(34)10-8-32/h5-6,13-16,18H,3-4,7-12H2,1-2H3,(H,28,29,30)/t18-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 6n/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