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Compile Data Set for Download or QSAR

Found 5 hits Enz. Inhib. hit(s) with Target = 'Dual specificity tyrosine-phosphorylation-regulated kinase 1A' and Ligand = 'BDBM293458'   
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
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM293458
PNG
(US10106527, Compound 62 | US10544128, Compound 62 ...)
Show SMILES CN(C)CCNc1cc(ccn1)C(=O)Nc1cc2cc(ccc2cn1)-c1cnn(C)c1
Show InChI InChI=1S/C23H25N7O/c1-29(2)9-8-25-21-11-17(6-7-24-21)23(31)28-22-12-19-10-16(4-5-18(19)13-26-22)20-14-27-30(3)15-20/h4-7,10-15H,8-9H2,1-3H3,(H,24,25)(H,26,28,31)
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n/an/an/an/a 2.30n/an/an/a25



Samumed, LLC

US Patent


Assay Description
Briefly, recombinant DYRK1A kinase, ATP and Ser/Thr peptide 18 were prepared in 1× Kinase buffer to final concentrations of 0.19 μg/mL, 30 μ...


US Patent US10106527 (2018)


BindingDB Entry DOI: 10.7270/Q2PN97Q3
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM293458
PNG
(US10106527, Compound 62 | US10544128, Compound 62 ...)
Show SMILES CN(C)CCNc1cc(ccn1)C(=O)Nc1cc2cc(ccc2cn1)-c1cnn(C)c1
Show InChI InChI=1S/C23H25N7O/c1-29(2)9-8-25-21-11-17(6-7-24-21)23(31)28-22-12-19-10-16(4-5-18(19)13-26-22)20-14-27-30(3)15-20/h4-7,10-15H,8-9H2,1-3H3,(H,24,25)(H,26,28,31)
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n/an/an/an/a 2.30n/an/an/an/a



Tanabe Research Laboratories USA



Assay Description
The DYRKIA kinase assay was run using the Ser/Thr 18 peptide Z-lyte assay kit according to manufacturer's instructions (Life Technologies-a Divis...


Bioorg Med Chem Lett 17: 4442-6 (2007)


BindingDB Entry DOI: 10.7270/Q2862JRD
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM293458
PNG
(US10106527, Compound 62 | US10544128, Compound 62 ...)
Show SMILES CN(C)CCNc1cc(ccn1)C(=O)Nc1cc2cc(ccc2cn1)-c1cnn(C)c1
Show InChI InChI=1S/C23H25N7O/c1-29(2)9-8-25-21-11-17(6-7-24-21)23(31)28-22-12-19-10-16(4-5-18(19)13-26-22)20-14-27-30(3)15-20/h4-7,10-15H,8-9H2,1-3H3,(H,24,25)(H,26,28,31)
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n/an/an/an/a 2.30n/an/an/an/a


TBA



Citation and Details

BindingDB Entry DOI: 10.7270/Q2SJ1QR6
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM293458
PNG
(US10106527, Compound 62 | US10544128, Compound 62 ...)
Show SMILES CN(C)CCNc1cc(ccn1)C(=O)Nc1cc2cc(ccc2cn1)-c1cnn(C)c1
Show InChI InChI=1S/C23H25N7O/c1-29(2)9-8-25-21-11-17(6-7-24-21)23(31)28-22-12-19-10-16(4-5-18(19)13-26-22)20-14-27-30(3)15-20/h4-7,10-15H,8-9H2,1-3H3,(H,24,25)(H,26,28,31)
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n/an/an/an/a 2.30n/an/an/an/a


TBA

Assay Description
The DYRKIA kinase assay was run using the Ser/Thr 18 peptide Z-lyte assay kit according to manufacturer's instructions (Life Technologies—a Divis...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2JW8JR2
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM293458
PNG
(US10106527, Compound 62 | US10544128, Compound 62 ...)
Show SMILES CN(C)CCNc1cc(ccn1)C(=O)Nc1cc2cc(ccc2cn1)-c1cnn(C)c1
Show InChI InChI=1S/C23H25N7O/c1-29(2)9-8-25-21-11-17(6-7-24-21)23(31)28-22-12-19-10-16(4-5-18(19)13-26-22)20-14-27-30(3)15-20/h4-7,10-15H,8-9H2,1-3H3,(H,24,25)(H,26,28,31)
PDB
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n/an/an/an/a 2.30n/an/an/an/a



Samumed, LLC

US Patent


Assay Description
The DYRKIA kinase assay was run using the Ser/Thr 18 peptide Z-lyte assay kit according to manufacturer's instructions (Life Technologies—a Divis...


US Patent US10544128 (2020)


BindingDB Entry DOI: 10.7270/Q2H134DS
More data for this
Ligand-Target Pair