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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Maternal embryonic leucine zipper kinase' and Ligand = 'BDBM166135'   
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
Maternal embryonic leucine zipper kinase


(Homo sapiens (Human))
BDBM166135
PNG
(US9067937, 79)
Show SMILES CC(C)C(N)C(=O)N[C@H]1CC[C@@H](CC1)Nc1c(cnc2ccc(nc12)-c1cc(Cl)c(O)c(Cl)c1)C(C)=O |r,wU:11.14,wD:8.7,(-.49,6.72,;.6,5.63,;2.08,6.03,;.2,4.14,;1.29,3.05,;-1.29,3.74,;-2.38,4.83,;-1.69,2.26,;-.6,1.17,;-1,-.32,;.09,-1.41,;1.58,-1.01,;1.98,.48,;.89,1.57,;2.67,-2.1,;2.67,-3.64,;4,-4.41,;4,-5.95,;2.67,-6.72,;1.33,-5.95,;,-6.72,;-1.33,-5.95,;-1.33,-4.41,;,-3.64,;1.33,-4.41,;-2.67,-3.64,;-2.67,-2.1,;-4,-1.33,;-4,.21,;-5.33,-2.1,;-6.67,-1.33,;-5.33,-3.64,;-6.67,-4.41,;-4,-4.41,;5.33,-3.64,;6.67,-4.41,;5.33,-2.1,)|
Show InChI InChI=1S/C27H31Cl2N5O3/c1-13(2)23(30)27(37)33-17-6-4-16(5-7-17)32-24-18(14(3)35)12-31-22-9-8-21(34-25(22)24)15-10-19(28)26(36)20(29)11-15/h8-13,16-17,23,36H,4-7,30H2,1-3H3,(H,31,32)(H,33,37)/t16-,17-,23?
PDB

KEGG

UniProtKB/SwissProt

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antibodypedia
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PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 1.60n/an/an/an/a7.425



OncoTherapy Science, Inc.

US Patent


Assay Description
MELK activity was determined in the presence or absence of compounds using fluorescein isothiocyanate-labeled (FITC-labeled) histone H3 peptide as a ...


US Patent US9067937 (2015)


BindingDB Entry DOI: 10.7270/Q2BR8QX4
More data for this
Ligand-Target Pair