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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'CaM Kinase II' and Ligand = 'BDBM6834'   
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
CaM Kinase II


(Rattus norvegicus (rat))
BDBM6834
PNG
(3-{3-[(2-hydroxyethyl)amino]propyl}-6-methoxy-18-m...)
Show SMILES COc1ccc2c(c1)n(CCCNCCO)c1c2c2C(=O)NC(=O)c2c2c3n(C)ccc3ccc12
Show InChI InChI=1S/C27H26N4O4/c1-30-12-8-15-4-6-18-21(24(15)30)23-22(26(33)29-27(23)34)20-17-7-5-16(35-2)14-19(17)31(25(18)20)11-3-9-28-10-13-32/h4-8,12,14,28,32H,3,9-11,13H2,1-2H3,(H,29,33,34)
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 732n/an/an/an/an/a25



Lilly Research Laboratories



Assay Description
In vitro kinase assay using purified enzyme, was incubated at room temperature with substrate, and test compounds in the presence of ATP/[gamma-33P]A...


Bioorg Med Chem Lett 13: 2261-7 (2003)


Article DOI: 10.1021/jm060173k
More data for this
Ligand-Target Pair