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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Isoform 2 of MAP kinase-interacting serine/threonine-protein kinase 1 (MNK1a) 344D]' and Ligand = 'BDBM343695'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Isoform 2 of MAP kinase-interacting serine/threonine-protein kinase 1 (MNK1a) 344D]


(Homo sapiens (Human))
BDBM343695
PNG
(N-(2-{[3-(1-Benzofuran-2-yl)imidazo[1,2-b]pyridazi...)
Show SMILES CC(C)(C)CNCC(Oc1ccc2ncc(-c3cc4ccccc4o3)n2n1)c1ccccc1 |w:8.7|
Show InChI InChI=1S/C27H28N4O2/c1-27(2,3)18-28-17-24(19-9-5-4-6-10-19)33-26-14-13-25-29-16-21(31(25)30-26)23-15-20-11-7-8-12-22(20)32-23/h4-16,24,28H,17-18H2,1-3H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 227n/an/an/an/an/an/a



BAYER INTELLECTUAL PROPERTY GMBH

US Patent


Assay Description
For the assay 50 nL of a 100fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384well microtiter plate (Gr...


US Patent US9777004 (2017)


BindingDB Entry DOI: 10.7270/Q2B27XDM
More data for this
Ligand-Target Pair
Isoform 2 of MAP kinase-interacting serine/threonine-protein kinase 1 (MNK1a) 344D]


(Homo sapiens (Human))
BDBM343695
PNG
(N-(2-{[3-(1-Benzofuran-2-yl)imidazo[1,2-b]pyridazi...)
Show SMILES CC(C)(C)CNCC(Oc1ccc2ncc(-c3cc4ccccc4o3)n2n1)c1ccccc1 |w:8.7|
Show InChI InChI=1S/C27H28N4O2/c1-27(2,3)18-28-17-24(19-9-5-4-6-10-19)33-26-14-13-25-29-16-21(31(25)30-26)23-15-20-11-7-8-12-22(20)32-23/h4-16,24,28H,17-18H2,1-3H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 239n/an/an/an/an/an/a



BAYER INTELLECTUAL PROPERTY GMBH

US Patent


Assay Description
For the assay 50 nL of a 100fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384well microtiter plate (Gr...


US Patent US9777004 (2017)


BindingDB Entry DOI: 10.7270/Q2B27XDM
More data for this
Ligand-Target Pair