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Compile Data Set for Download or QSAR

Found 291 hits with Last Name = 'edmonds' and Initial = 't'   
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))
BDBM50581228
PNG
(CHEMBL5081341)
Show SMILES COc1nc(C)nc2[nH]cc(-c3ccnc(N)c3)c12
PDB
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10n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity to DYRK1A (unknown origin) assessed as inhibition constant by ADP hunter plus assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00024
BindingDB Entry DOI: 10.7270/Q28W3J52
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50581229
PNG
(CHEMBL5092245)
Show SMILES COc1nc(C)nc2[nH]cc(-c3ccnc(C)c3)c12
PDB
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20n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity to DYRK1A (unknown origin) assessed as inhibition constant by ADP hunter plus assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00024
BindingDB Entry DOI: 10.7270/Q28W3J52
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50581227
PNG
(CHEMBL5083242)
Show SMILES COc1nc(C)nc2[nH]cc(-c3ccncc3)c12
PDB
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20n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity to DYRK1A (unknown origin) assessed as inhibition constant by ADP hunter plus assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00024
BindingDB Entry DOI: 10.7270/Q28W3J52
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50581225
PNG
(CHEMBL5091344)
Show SMILES Cc1nc(N)c2c(C#N)c([nH]c2n1)-c1cccnc1
PDB
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32n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity to DYRK1A (unknown origin) assessed as inhibition constant by ADP hunter plus assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00024
BindingDB Entry DOI: 10.7270/Q28W3J52
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50581222
PNG
(CHEMBL5091537)
Show SMILES Cc1nc(N)c2c(C#N)c(-c3cccc(F)c3F)n(C)c2n1 |(67.73,-22.18,;66.4,-21.41,;65.06,-22.19,;63.72,-21.41,;62.38,-22.19,;63.72,-19.87,;62.58,-18.84,;61.07,-19.16,;59.55,-19.48,;63.2,-17.43,;62.43,-16.1,;60.9,-16.1,;60.13,-14.78,;60.9,-13.43,;62.44,-13.43,;63.2,-12.1,;63.21,-14.76,;64.74,-14.76,;64.74,-17.59,;65.77,-16.44,;65.06,-19.1,;66.4,-19.87,)|
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59n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity to DYRK1A (unknown origin) assessed as inhibition constant by ADP hunter plus assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00024
BindingDB Entry DOI: 10.7270/Q28W3J52
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50381865
PNG
(CHEMBL2023701)
Show SMILES COc1ccc(cc1)-c1cc(N)nc(N)n1
Show InChI InChI=1S/C11H12N4O/c1-16-8-4-2-7(3-5-8)9-6-10(12)15-11(13)14-9/h2-6H,1H3,(H4,12,13,14,15)
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100n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity to DYRK1A (unknown origin) assessed as inhibition constant by ADP hunter plus assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00024
BindingDB Entry DOI: 10.7270/Q28W3J52
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50581221
PNG
(CHEMBL5076663)
Show SMILES CCn1c(c(C#N)c2c(N)nc(C)nc12)-c1cccc(F)c1F |(54.34,-17.21,;52.83,-16.89,;51.8,-18.03,;50.27,-17.87,;49.64,-19.29,;48.13,-19.61,;46.62,-19.93,;50.78,-20.31,;50.78,-21.86,;49.44,-22.64,;52.12,-22.64,;53.46,-21.86,;54.8,-22.63,;53.46,-20.31,;52.12,-19.55,;49.5,-16.54,;47.97,-16.55,;47.19,-15.22,;47.96,-13.88,;49.5,-13.88,;50.27,-12.55,;50.27,-15.21,;51.81,-15.21,)|
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120n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity to DYRK1A (unknown origin) assessed as inhibition constant by ADP hunter plus assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00024
BindingDB Entry DOI: 10.7270/Q28W3J52
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50581231
PNG
(CHEMBL5090400)
Show SMILES COc1nc(C)nc2[nH]cc(-c3ccnc(F)c3)c12
PDB
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120n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity to DYRK1A (unknown origin) assessed as inhibition constant by ADP hunter plus assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00024
BindingDB Entry DOI: 10.7270/Q28W3J52
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50581224
PNG
(CHEMBL5086979)
Show SMILES Cc1nc(N)c2c(C#N)c(-c3cccnc3)n(C)c2n1
PDB
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190n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity to DYRK1A (unknown origin) assessed as inhibition constant by ADP hunter plus assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00024
BindingDB Entry DOI: 10.7270/Q28W3J52
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50581220
PNG
(CHEMBL5085619)
Show SMILES CCn1c(c(C#N)c2c(N)nc(C)nc12)-c1cccnc1
PDB
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890n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity to DYRK1A (unknown origin) assessed as inhibition constant by ADP hunter plus assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00024
BindingDB Entry DOI: 10.7270/Q28W3J52
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50581223
PNG
(CHEMBL5077073)
Show SMILES COc1cccc(-c2c(C#N)c3c(N)nc(C)nc3n2C)c1C |(75.98,-11.92,;74.44,-11.92,;73.67,-13.25,;72.13,-13.25,;71.36,-14.59,;72.14,-15.92,;73.67,-15.92,;74.44,-17.25,;73.81,-18.66,;72.3,-18.98,;70.79,-19.3,;74.96,-19.69,;74.96,-21.23,;73.62,-22.01,;76.3,-22.01,;77.64,-21.23,;78.97,-22,;77.64,-19.69,;76.3,-18.92,;75.98,-17.41,;77.01,-16.26,;74.44,-14.58,;75.98,-14.58,)|
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1.50E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity to DYRK1A (unknown origin) assessed as inhibition constant by ADP hunter plus assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00024
BindingDB Entry DOI: 10.7270/Q28W3J52
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50028122
PNG
(2-Amino-3,7-dihydro-pyrrolo[2,3-d]pyrimidin-4-one ...)
Show SMILES Nc1nc2[nH]ccc2c(=O)[nH]1
Show InChI InChI=1S/C6H6N4O/c7-6-9-4-3(1-2-8-4)5(11)10-6/h1-2H,(H4,7,8,9,10,11)
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1.50E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity to DYRK1A (unknown origin) assessed as inhibition constant by ADP hunter plus assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00024
BindingDB Entry DOI: 10.7270/Q28W3J52
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50581218
PNG
(CHEMBL5089793)
Show SMILES Nc1ncc(Cl)c2sccc12
PDB
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1.50E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity to DYRK1A (unknown origin) assessed as inhibition constant by ADP hunter plus assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00024
BindingDB Entry DOI: 10.7270/Q28W3J52
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50581217
PNG
(CHEMBL2432026)
Show SMILES O=c1[nH]cnc2[nH]nc(-c3ccccc3)c12
PDB
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2.30E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity to DYRK1A (unknown origin) assessed as inhibition constant by ADP hunter plus assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00024
BindingDB Entry DOI: 10.7270/Q28W3J52
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50581230
PNG
(CHEMBL5088612)
Show SMILES COc1nc(C)nc2[nH]cc(-c3cccc(c3)C(N)=O)c12
PDB
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2.40E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity to DYRK1A (unknown origin) assessed as inhibition constant by ADP hunter plus assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00024
BindingDB Entry DOI: 10.7270/Q28W3J52
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50065309
PNG
(3-(5-Methyl-furan-2-ylmethylene)-1,3-dihydro-indol...)
Show SMILES Cc1ccc(\C=C2\C(=O)Nc3ccccc23)o1
Show InChI InChI=1S/C14H11NO2/c1-9-6-7-10(17-9)8-12-11-4-2-3-5-13(11)15-14(12)16/h2-8H,1H3,(H,15,16)/b12-8+
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4.40E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity to DYRK1A (unknown origin) assessed as inhibition constant by ADP hunter plus assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00024
BindingDB Entry DOI: 10.7270/Q28W3J52
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50581215
PNG
(CHEMBL3751985 | EN300-762940)
Show SMILES COc1ccc(cc1)-c1cc(N)[nH]n1
PDB
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6.10E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity to DYRK1A (unknown origin) assessed as inhibition constant by ADP hunter plus assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00024
BindingDB Entry DOI: 10.7270/Q28W3J52
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50581216
PNG
(CHEMBL5081135)
Show SMILES Cn1c(Br)c(C#N)c2c(N)ncnc12
PDB
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6.40E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity to DYRK1A (unknown origin) assessed as inhibition constant by ADP hunter plus assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00024
BindingDB Entry DOI: 10.7270/Q28W3J52
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50581232
PNG
(CHEMBL5075490)
Show SMILES COc1nc(C)nc2[nH]cc(-c3ccc(F)cc3)c12
PDB
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2.50E+4n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity to DYRK1A (unknown origin) assessed as inhibition constant by ADP hunter plus assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00024
BindingDB Entry DOI: 10.7270/Q28W3J52
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50581219
PNG
(CHEMBL5071361)
Show SMILES Cn1cc(cn1)-c1cc(n[nH]1)C(O)=O
PDB
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>2.00E+5n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity to DYRK1A (unknown origin) assessed as inhibition constant by ADP hunter plus assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00024
BindingDB Entry DOI: 10.7270/Q28W3J52
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1B


(Homo sapiens (Human))
BDBM50581233
PNG
(CHEMBL5091510)
Show SMILES Cc1nc(OCc2ccsc2)c2c(c[nH]c2n1)-c1ccnc(N)c1
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n/an/a 1n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of DYRK1B (unknown origin) by TR FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00024
BindingDB Entry DOI: 10.7270/Q28W3J52
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1B


(Homo sapiens (Human))
BDBM50581236
PNG
(CHEMBL5090676)
Show SMILES Cc1nc(OCc2cncs2)c2c(c[nH]c2n1)-c1ccnc(N)c1
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n/an/a 1n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of DYRK1B (unknown origin) by TR FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00024
BindingDB Entry DOI: 10.7270/Q28W3J52
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50583753
PNG
(CHEMBL5088511)
Show SMILES Cc1nc2ccc(nc2n1CCOc1ccccc1)-c1cc(N)nc(N)c1
PDB
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n/an/a 1n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of DYRK1A (unknown origin) using Ulight-MBP as substrate and ATP as co-substrate incubated for 40 mins and measured after 1 hr by TR-FRET ...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00023
BindingDB Entry DOI: 10.7270/Q20K2DF1
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Dual specificity tyrosine-phosphorylation-regulated kinase 1B


(Homo sapiens (Human))
BDBM50581240
PNG
(CHEMBL5083159)
Show SMILES Cc1nc(NCc2ccsc2)c2c(c[nH]c2n1)-c1ccnc(N)c1
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n/an/a 1n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of DYRK1B (unknown origin) by TR FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00024
BindingDB Entry DOI: 10.7270/Q28W3J52
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1B


(Homo sapiens (Human))
BDBM50581238
PNG
(CHEMBL5092157)
Show SMILES Cc1nc(NCc2ccccc2)c2c(c[nH]c2n1)-c1ccnc(N)c1
PDB

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n/an/a 1n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of DYRK1B (unknown origin) by TR FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00024
BindingDB Entry DOI: 10.7270/Q28W3J52
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 2


(Homo sapiens (Human))
BDBM50583748
PNG
(CHEMBL5084504)
Show SMILES Cc1nc2ccc(nc2n1C1CCCC1)-c1cc(N)nc(N)c1
PDB
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n/an/a 1n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of DYRK2 (unknown origin) using Ulight-MBP as substrate and ATP as co-substrate incubated for 40 mins and measured after 1 hr by TR-FRET a...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00023
BindingDB Entry DOI: 10.7270/Q20K2DF1
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50583757
PNG
(CHEMBL5073869)
Show SMILES Cc1oc2ccc(cc2c1C)-c1cc(N)nc(N)c1
PDB
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TBA

Assay Description
Inhibition of DYRK1A (unknown origin) using Ulight-MBP as substrate and ATP as co-substrate incubated for 40 mins and measured after 1 hr by TR-FRET ...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00023
BindingDB Entry DOI: 10.7270/Q20K2DF1
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50583723
PNG
(CHEMBL5092882)
Show SMILES Nc1cc(cc(N)n1)-c1ccc2ncsc2c1
PDB
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TBA

Assay Description
Inhibition of DYRK1A (unknown origin) using Ulight-MBP as substrate and ATP as co-substrate incubated for 40 mins and measured after 1 hr by TR-FRET ...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00023
BindingDB Entry DOI: 10.7270/Q20K2DF1
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1B


(Homo sapiens (Human))
BDBM50581239
PNG
(CHEMBL5082044)
Show SMILES Cc1nc(NCc2cccs2)c2c(c[nH]c2n1)-c1ccnc(N)c1
PDB

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TBA

Assay Description
Inhibition of DYRK1B (unknown origin) by TR FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00024
BindingDB Entry DOI: 10.7270/Q28W3J52
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50583755
PNG
(CHEMBL5070553)
Show SMILES Cc1nc2ccc(nc2n1CC(F)(F)F)-c1cc(N)nc(N)c1
PDB
MMDB

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TBA

Assay Description
Inhibition of DYRK1A (unknown origin) using Ulight-MBP as substrate and ATP as co-substrate incubated for 40 mins and measured after 1 hr by TR-FRET ...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00023
BindingDB Entry DOI: 10.7270/Q20K2DF1
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50583762
PNG
(CHEMBL5089171)
Show SMILES Cc1nc2ccc(nc2n1CCOc1cccc(Br)n1)-c1cc(N)nc(N)c1
PDB
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TBA

Assay Description
Inhibition of DYRK1A (unknown origin) using Ulight-MBP as substrate and ATP as co-substrate incubated for 40 mins and measured after 1 hr by TR-FRET ...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00023
BindingDB Entry DOI: 10.7270/Q20K2DF1
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50583744
PNG
(CHEMBL5082456)
Show SMILES CCCCn1c(C)nc2ccc(nc12)-c1cc(N)nc(N)c1
PDB
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TBA

Assay Description
Inhibition of DYRK1A (unknown origin) using Ulight-MBP as substrate and ATP as co-substrate incubated for 40 mins and measured after 1 hr by TR-FRET ...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00023
BindingDB Entry DOI: 10.7270/Q20K2DF1
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 2


(Homo sapiens (Human))
BDBM50581236
PNG
(CHEMBL5090676)
Show SMILES Cc1nc(OCc2cncs2)c2c(c[nH]c2n1)-c1ccnc(N)c1
PDB
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TBA

Assay Description
Inhibition of DYRK2 (unknown origin) by TR FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00024
BindingDB Entry DOI: 10.7270/Q28W3J52
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50583728
PNG
(CHEMBL5081583)
Show SMILES Nc1cc(cc(N)n1)-c1ccn2nccc2n1
PDB
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TBA

Assay Description
Inhibition of DYRK1A (unknown origin) using Ulight-MBP as substrate and ATP as co-substrate incubated for 40 mins and measured after 1 hr by TR-FRET ...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00023
BindingDB Entry DOI: 10.7270/Q20K2DF1
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1B


(Homo sapiens (Human))
BDBM50581211
PNG
(CHEMBL5093650)
Show SMILES Cc1nc(NCc2c(F)cccc2F)c2c(c[nH]c2n1)-c1ccnc(N)c1
PDB

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TBA

Assay Description
Inhibition of DYRK1B (unknown origin) by TR FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00024
BindingDB Entry DOI: 10.7270/Q28W3J52
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50583752
PNG
(CHEMBL5073976)
Show SMILES Cc1nc2ccc(nc2n1CCc1ccco1)-c1cc(N)nc(N)c1
PDB
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TBA

Assay Description
Inhibition of DYRK1A (unknown origin) using Ulight-MBP as substrate and ATP as co-substrate incubated for 40 mins and measured after 1 hr by TR-FRET ...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00023
BindingDB Entry DOI: 10.7270/Q20K2DF1
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50581214
PNG
(CHEMBL5078833)
Show SMILES Cc1nc(-c2ccc3OCOc3c2)c2c(c[nH]c2n1)-c1ccnc(N)c1
PDB
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TBA

Assay Description
Inhibition of DYRK1A (unknown origin) by TR FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00024
BindingDB Entry DOI: 10.7270/Q28W3J52
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50583754
PNG
(CHEMBL5077927)
Show SMILES Cc1nc2ccc(nc2n1CC(F)F)-c1cc(N)nc(N)c1
PDB
MMDB

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TBA

Assay Description
Inhibition of DYRK1A (unknown origin) using Ulight-MBP as substrate and ATP as co-substrate incubated for 40 mins and measured after 1 hr by TR-FRET ...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00023
BindingDB Entry DOI: 10.7270/Q20K2DF1
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50583763
PNG
(CHEMBL5093661)
Show SMILES Cc1nc2ccc(nc2n1CCOc1cccc(Cl)n1)-c1cc(N)nc(N)c1
PDB
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TBA

Assay Description
Inhibition of DYRK1A (unknown origin) using Ulight-MBP as substrate and ATP as co-substrate incubated for 40 mins and measured after 1 hr by TR-FRET ...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00023
BindingDB Entry DOI: 10.7270/Q20K2DF1
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 2


(Homo sapiens (Human))
BDBM50530430
PNG
(CHEMBL4460561)
Show SMILES Cc1nc2ccc(nc2n1C1CC1)-c1cc(N)nc(N)c1
Show InChI InChI=1S/C15H16N6/c1-8-18-12-5-4-11(9-6-13(16)20-14(17)7-9)19-15(12)21(8)10-2-3-10/h4-7,10H,2-3H2,1H3,(H4,16,17,20)
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TBA

Assay Description
Inhibition of DYRK2 (unknown origin) using Ulight-MBP as substrate and ATP as co-substrate incubated for 40 mins and measured after 1 hr by TR-FRET a...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00023
BindingDB Entry DOI: 10.7270/Q20K2DF1
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50583750
PNG
(CHEMBL5072926)
Show SMILES Cc1nc2ccc(nc2n1CCC1CCCCC1)-c1cc(N)nc(N)c1
PDB
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TBA

Assay Description
Inhibition of DYRK1A (unknown origin) using Ulight-MBP as substrate and ATP as co-substrate incubated for 40 mins and measured after 1 hr by TR-FRET ...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00023
BindingDB Entry DOI: 10.7270/Q20K2DF1
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 2


(Homo sapiens (Human))
BDBM50583754
PNG
(CHEMBL5077927)
Show SMILES Cc1nc2ccc(nc2n1CC(F)F)-c1cc(N)nc(N)c1
PDB
MMDB

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TBA

Assay Description
Inhibition of DYRK2 (unknown origin) using Ulight-MBP as substrate and ATP as co-substrate incubated for 40 mins and measured after 1 hr by TR-FRET a...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00023
BindingDB Entry DOI: 10.7270/Q20K2DF1
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50581211
PNG
(CHEMBL5093650)
Show SMILES Cc1nc(NCc2c(F)cccc2F)c2c(c[nH]c2n1)-c1ccnc(N)c1
PDB
MMDB

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TBA

Assay Description
Inhibition of DYRK1A (unknown origin) by TR FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00024
BindingDB Entry DOI: 10.7270/Q28W3J52
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50581213
PNG
(CHEMBL5088687)
Show SMILES Cc1nc(NCc2ncccc2F)c2c(c[nH]c2n1)-c1ccnc(N)c1
PDB
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TBA

Assay Description
Inhibition of DYRK1A (unknown origin) by TR FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00024
BindingDB Entry DOI: 10.7270/Q28W3J52
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 2


(Homo sapiens (Human))
BDBM50583749
PNG
(CHEMBL5089294)
Show SMILES COCCCn1c(C)nc2ccc(nc12)-c1cc(N)nc(N)c1
PDB
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TBA

Assay Description
Inhibition of DYRK2 (unknown origin) using Ulight-MBP as substrate and ATP as co-substrate incubated for 40 mins and measured after 1 hr by TR-FRET a...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00023
BindingDB Entry DOI: 10.7270/Q20K2DF1
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50583764
PNG
(CHEMBL5084166)
Show SMILES C[C@H](Cn1c(C)nc2ccc(nc12)-c1cc(N)nc(N)c1)Oc1cccc(Br)n1 |r|
PDB
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TBA

Assay Description
Inhibition of DYRK1A (unknown origin) using Ulight-MBP as substrate and ATP as co-substrate incubated for 40 mins and measured after 1 hr by TR-FRET ...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00023
BindingDB Entry DOI: 10.7270/Q20K2DF1
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50583756
PNG
(CHEMBL5080497)
Show SMILES Cc1nc2ccc(nc2n1CCCC(F)(F)F)-c1cc(N)nc(N)c1
PDB
MMDB

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TBA

Assay Description
Inhibition of DYRK1A (unknown origin) using Ulight-MBP as substrate and ATP as co-substrate incubated for 40 mins and measured after 1 hr by TR-FRET ...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00023
BindingDB Entry DOI: 10.7270/Q20K2DF1
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50583759
PNG
(CHEMBL5077422)
Show SMILES Cc1nc2ccc(nc2n1CCOc1ccccn1)-c1cc(N)nc(N)c1
PDB
MMDB

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TBA

Assay Description
Inhibition of DYRK1A (unknown origin) using Ulight-MBP as substrate and ATP as co-substrate incubated for 40 mins and measured after 1 hr by TR-FRET ...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00023
BindingDB Entry DOI: 10.7270/Q20K2DF1
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50583749
PNG
(CHEMBL5089294)
Show SMILES COCCCn1c(C)nc2ccc(nc12)-c1cc(N)nc(N)c1
PDB
MMDB

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TBA

Assay Description
Inhibition of DYRK1A (unknown origin) using Ulight-MBP as substrate and ATP as co-substrate incubated for 40 mins and measured after 1 hr by TR-FRET ...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00023
BindingDB Entry DOI: 10.7270/Q20K2DF1
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50581238
PNG
(CHEMBL5092157)
Show SMILES Cc1nc(NCc2ccccc2)c2c(c[nH]c2n1)-c1ccnc(N)c1
PDB
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TBA

Assay Description
Inhibition of DYRK1A (unknown origin) by TR FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00024
BindingDB Entry DOI: 10.7270/Q28W3J52
More data for this
Ligand-Target Pair
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