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SMILES: CC1(C)CCCC11NC(=O)c2ccc(Nc3ccncn3)c(=O)n12

InChI Key: InChIKey=VEEXATBXYUTWTO-UHFFFAOYSA-N

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 = 168205   
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))
BDBM168205
PNG
(US9669031, 36 2′,2′-dimethyl-6-(pyrimi...)
Show SMILES CC1(C)CCCC11NC(=O)c2ccc(Nc3ccncn3)c(=O)n12
Show InChI InChI=1S/C17H19N5O2/c1-16(2)7-3-8-17(16)21-14(23)12-5-4-11(15(24)22(12)17)20-13-6-9-18-10-19-13/h4-6,9-10H,3,7-8H2,1-2H3,(H,21,23)(H,18,19,20)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<10n/an/an/an/an/a25



eFFECTOR THERAPEUTICS, INC.

US Patent


Assay Description
Compounds are screened for Mnk inhibition using the ADP-Glo kinase assay kit (Promega, catalogue No. V9101). All kinase reactions are performed in Re...


US Patent US9669031 (2017)


BindingDB Entry DOI: 10.7270/Q26Q1VDT
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 1


(Homo sapiens (Human))
BDBM168205
PNG
(US9669031, 36 2′,2′-dimethyl-6-(pyrimi...)
Show SMILES CC1(C)CCCC11NC(=O)c2ccc(Nc3ccncn3)c(=O)n12
Show InChI InChI=1S/C17H19N5O2/c1-16(2)7-3-8-17(16)21-14(23)12-5-4-11(15(24)22(12)17)20-13-6-9-18-10-19-13/h4-6,9-10H,3,7-8H2,1-2H3,(H,21,23)(H,18,19,20)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<10n/an/an/an/an/a25



eFFECTOR THERAPEUTICS, INC.

US Patent


Assay Description
Compounds are screened for Mnk inhibition using the ADP-Glo kinase assay kit (Promega, catalogue No. V9101). All kinase reactions are performed in Re...


US Patent US9669031 (2017)


BindingDB Entry DOI: 10.7270/Q26Q1VDT
More data for this
Ligand-Target Pair