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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'MAP kinase-activated protein kinase 2' and Ligand = 'BDBM50045419'   
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
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))
BDBM50045419
PNG
(CHEMBL3314146)
Show SMILES Clc1ccc(cc1)-c1ccc(o1)-c1nc2ccccc2n1-c1ccc(cc1)N1CCNCC1
Show InChI InChI=1S/C27H23ClN4O/c28-20-7-5-19(6-8-20)25-13-14-26(33-25)27-30-23-3-1-2-4-24(23)32(27)22-11-9-21(10-12-22)31-17-15-29-16-18-31/h1-14,29H,15-18H2
PDB
MMDB

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Similars

Article
PubMed
n/an/a 95n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of MK2 (unknown origin) incubated for 30 mins by MK2 IMAP assay


Bioorg Med Chem Lett 24: 3609-13 (2014)


Article DOI: 10.1016/j.bmcl.2014.05.024
BindingDB Entry DOI: 10.7270/Q2F47QR7
More data for this
Ligand-Target Pair