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BDBM375555 4-(6-(4-(1,4-diazepane-1-carbonyl)phenyl)imidazo[1,2-a]pyridin-3-yl)benzonitrile::US9908886, Example 107

SMILES: O=C(N1CCCNCC1)c1ccc(cc1)-c1ccc2ncc(-c3ccc(cc3)C#N)n2c1

InChI Key: InChIKey=OPYNTMLXODTTLZ-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 = 375555   
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))
BDBM375555
PNG
(4-(6-(4-(1,4-diazepane-1-carbonyl)phenyl)imidazo[1...)
Show SMILES O=C(N1CCCNCC1)c1ccc(cc1)-c1ccc2ncc(-c3ccc(cc3)C#N)n2c1
Show InChI InChI=1S/C26H23N5O/c27-16-19-2-4-21(5-3-19)24-17-29-25-11-10-23(18-31(24)25)20-6-8-22(9-7-20)26(32)30-14-1-12-28-13-15-30/h2-11,17-18,28H,1,12-15H2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



University of Mississippi



Assay Description
MNK1 and MNK2 inhibitor activity was determined using recombinant kinase domains expressed in E. coli. MNK1 and MNK2 were expressed as GST fusion pro...


J Med Chem 50: 3841-50 (2007)


BindingDB Entry DOI: 10.7270/Q2XP777K
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 1


(Homo sapiens (Human))
BDBM375555
PNG
(4-(6-(4-(1,4-diazepane-1-carbonyl)phenyl)imidazo[1...)
Show SMILES O=C(N1CCCNCC1)c1ccc(cc1)-c1ccc2ncc(-c3ccc(cc3)C#N)n2c1
Show InChI InChI=1S/C26H23N5O/c27-16-19-2-4-21(5-3-19)24-17-29-25-11-10-23(18-31(24)25)20-6-8-22(9-7-20)26(32)30-14-1-12-28-13-15-30/h2-11,17-18,28H,1,12-15H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



University of Mississippi



Assay Description
MNK1 and MNK2 inhibitor activity was determined using recombinant kinase domains expressed in E. coli. MNK1 and MNK2 were expressed as GST fusion pro...


J Med Chem 50: 3841-50 (2007)


BindingDB Entry DOI: 10.7270/Q2XP777K
More data for this
Ligand-Target Pair