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Compile Data Set for Download or QSAR

Found 191 hits with Last Name = 'basnet' and Initial = 'skc'   
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
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM370121
PNG
(6-(difluoromethyl)-8-[(1R,2R)-2-hydroxy-2-methylcy...)
Show SMILES C[C@@]1(O)CCC[C@H]1n1c2nc(NC3CCN(CC3)S(C)(=O)=O)ncc2cc(C(F)F)c1=O |r|
Show InChI InChI=1S/C20H27F2N5O4S/c1-20(29)7-3-4-15(20)27-17-12(10-14(16(21)22)18(27)28)11-23-19(25-17)24-13-5-8-26(9-6-13)32(2,30)31/h10-11,13,15-16,29H,3-9H2,1-2H3,(H,23,24,25)/t15-,20-/m1/s1
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Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50611455
PNG
(CHEMBL5286090)
Show SMILES Cn1cc(cn1)-c1nc(Nc2ccc(cc2)S(N)(=O)=O)ncc1Cl
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Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50139171
PNG
(Dinaciclib | MK-7965 | SCH-727965 | US11643396, Ex...)
Show SMILES CCc1cnn2c(NCc3ccc[n+]([O-])c3)cc(nc12)N1CCCC[C@H]1CCO |r|
Show InChI InChI=1S/C21H28N6O2/c1-2-17-14-23-27-19(22-13-16-6-5-9-25(29)15-16)12-20(24-21(17)27)26-10-4-3-7-18(26)8-11-28/h5-6,9,12,14-15,18,22,28H,2-4,7-8,10-11,13H2,1H3/t18-/m0/s1
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Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 1


(Homo sapiens (Human))
BDBM168281
PNG
(US9669031, 109 8-chloro-6-(pyrimidin-4-ylamino)spi...)
Show SMILES Clc1cc(Nc2ccncn2)c(=O)n2c1C(=O)NC21CCCCC1
Show InChI InChI=1S/C16H16ClN5O2/c17-10-8-11(20-12-4-7-18-9-19-12)15(24)22-13(10)14(23)21-16(22)5-2-1-3-6-16/h4,7-9H,1-3,5-6H2,(H,21,23)(H,18,19,20)
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2n/an/an/an/an/an/an/an/a



University of South Australia

Curated by ChEMBL


Assay Description
Inhibition of recombinant GST-tagged MNK1 (unknown origin) using eIF4E-derived peptide as substrate in presence of ATP at km concentration by ADP-Glo...


Bioorg Med Chem Lett 29: 2650-2654 (2019)


Article DOI: 10.1016/j.bmcl.2019.07.043
BindingDB Entry DOI: 10.7270/Q2B56P2W
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50611459
PNG
(CHEMBL5277565)
Show SMILES Cc1nn(C)cc1-c1nc(NC2CCN(CC2)S(C)(=O)=O)ncc1Cl
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Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50431360
PNG
(CHEMBL2347597)
Show SMILES CNc1nc(C)c(s1)-c1nc(Nc2cccc(c2)S(N)(=O)=O)ncc1F
Show InChI InChI=1S/C15H15FN6O2S2/c1-8-13(25-15(18-2)20-8)12-11(16)7-19-14(22-12)21-9-4-3-5-10(6-9)26(17,23)24/h3-7H,1-2H3,(H,18,20)(H2,17,23,24)(H,19,21,22)
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Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50139171
PNG
(Dinaciclib | MK-7965 | SCH-727965 | US11643396, Ex...)
Show SMILES CCc1cnn2c(NCc3ccc[n+]([O-])c3)cc(nc12)N1CCCC[C@H]1CCO |r|
Show InChI InChI=1S/C21H28N6O2/c1-2-17-14-23-27-19(22-13-16-6-5-9-25(29)15-16)12-20(24-21(17)27)26-10-4-3-7-18(26)8-11-28/h5-6,9,12,14-15,18,22,28H,2-4,7-8,10-11,13H2,1H3/t18-/m0/s1
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Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM50263263
PNG
(CHEMBL4073443)
Show SMILES Cc1cc(Nc2cc(N)ncn2)c(=O)n2c1C(=O)NC21CCCCC1
Show InChI InChI=1S/C17H20N6O2/c1-10-7-11(21-13-8-12(18)19-9-20-13)16(25)23-14(10)15(24)22-17(23)5-3-2-4-6-17/h7-9H,2-6H2,1H3,(H,22,24)(H3,18,19,20,21)
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3n/an/an/an/an/an/an/an/a



University of South Australia

Curated by ChEMBL


Assay Description
Inhibition of recombinant His-tagged MNK2 (unknown origin) using eIF4E-derived peptide as substrate in presence of ATP at Km concentration by ADP-Glo...


Bioorg Med Chem Lett 29: 2650-2654 (2019)


Article DOI: 10.1016/j.bmcl.2019.07.043
BindingDB Entry DOI: 10.7270/Q2B56P2W
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
MAP kinase-interacting serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM168281
PNG
(US9669031, 109 8-chloro-6-(pyrimidin-4-ylamino)spi...)
Show SMILES Clc1cc(Nc2ccncn2)c(=O)n2c1C(=O)NC21CCCCC1
Show InChI InChI=1S/C16H16ClN5O2/c17-10-8-11(20-12-4-7-18-9-19-12)15(24)22-13(10)14(23)21-16(22)5-2-1-3-6-16/h4,7-9H,1-3,5-6H2,(H,21,23)(H,18,19,20)
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3n/an/an/an/an/an/an/an/a



University of South Australia

Curated by ChEMBL


Assay Description
Inhibition of recombinant His-tagged MNK2 (unknown origin) using eIF4E-derived peptide as substrate in presence of ATP at Km concentration by ADP-Glo...


Bioorg Med Chem Lett 29: 2650-2654 (2019)


Article DOI: 10.1016/j.bmcl.2019.07.043
BindingDB Entry DOI: 10.7270/Q2B56P2W
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50431360
PNG
(CHEMBL2347597)
Show SMILES CNc1nc(C)c(s1)-c1nc(Nc2cccc(c2)S(N)(=O)=O)ncc1F
Show InChI InChI=1S/C15H15FN6O2S2/c1-8-13(25-15(18-2)20-8)12-11(16)7-19-14(22-12)21-9-4-3-5-10(6-9)26(17,23)24/h3-7H,1-2H3,(H,18,20)(H2,17,23,24)(H,19,21,22)
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Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50431360
PNG
(CHEMBL2347597)
Show SMILES CNc1nc(C)c(s1)-c1nc(Nc2cccc(c2)S(N)(=O)=O)ncc1F
Show InChI InChI=1S/C15H15FN6O2S2/c1-8-13(25-15(18-2)20-8)12-11(16)7-19-14(22-12)21-9-4-3-5-10(6-9)26(17,23)24/h3-7H,1-2H3,(H,18,20)(H2,17,23,24)(H,19,21,22)
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Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50431360
PNG
(CHEMBL2347597)
Show SMILES CNc1nc(C)c(s1)-c1nc(Nc2cccc(c2)S(N)(=O)=O)ncc1F
Show InChI InChI=1S/C15H15FN6O2S2/c1-8-13(25-15(18-2)20-8)12-11(16)7-19-14(22-12)21-9-4-3-5-10(6-9)26(17,23)24/h3-7H,1-2H3,(H,18,20)(H2,17,23,24)(H,19,21,22)
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More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50431360
PNG
(CHEMBL2347597)
Show SMILES CNc1nc(C)c(s1)-c1nc(Nc2cccc(c2)S(N)(=O)=O)ncc1F
Show InChI InChI=1S/C15H15FN6O2S2/c1-8-13(25-15(18-2)20-8)12-11(16)7-19-14(22-12)21-9-4-3-5-10(6-9)26(17,23)24/h3-7H,1-2H3,(H,18,20)(H2,17,23,24)(H,19,21,22)
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More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50431360
PNG
(CHEMBL2347597)
Show SMILES CNc1nc(C)c(s1)-c1nc(Nc2cccc(c2)S(N)(=O)=O)ncc1F
Show InChI InChI=1S/C15H15FN6O2S2/c1-8-13(25-15(18-2)20-8)12-11(16)7-19-14(22-12)21-9-4-3-5-10(6-9)26(17,23)24/h3-7H,1-2H3,(H,18,20)(H2,17,23,24)(H,19,21,22)
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Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50593923
PNG
(CHEMBL5195030)
Show SMILES CC[C@@H](Nc1nc(NCc2cnc(C)cc2C)c2ncn(C(C)C)c2n1)[C@H](C)O |r|
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Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50611455
PNG
(CHEMBL5286090)
Show SMILES Cn1cc(cn1)-c1nc(Nc2ccc(cc2)S(N)(=O)=O)ncc1Cl
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Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3


(Homo sapiens (Human))
BDBM50277622
PNG
(CHEMBL4162390)
Show SMILES COc1ccc(Nc2nccc(n2)-c2sc(nc2C)N(C)C)c(OC)c1
Show InChI InChI=1S/C18H21N5O2S/c1-11-16(26-18(20-11)23(2)3)14-8-9-19-17(22-14)21-13-7-6-12(24-4)10-15(13)25-5/h6-10H,1-5H3,(H,19,21,22)
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5n/an/an/an/an/an/an/an/a



University of South Australia

Curated by ChEMBL


Assay Description
Inhibition of recombinant human FLT3 using EAIYAAPFAKKK as substrate by ATP-Glo assay


Eur J Med Chem 139: 762-772 (2017)


Article DOI: 10.1016/j.ejmech.2017.08.006
BindingDB Entry DOI: 10.7270/Q24B33VW
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 1


(Homo sapiens (Human))
BDBM50263263
PNG
(CHEMBL4073443)
Show SMILES Cc1cc(Nc2cc(N)ncn2)c(=O)n2c1C(=O)NC21CCCCC1
Show InChI InChI=1S/C17H20N6O2/c1-10-7-11(21-13-8-12(18)19-9-20-13)16(25)23-14(10)15(24)22-17(23)5-3-2-4-6-17/h7-9H,2-6H2,1H3,(H,22,24)(H3,18,19,20,21)
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5n/an/an/an/an/an/an/an/a



University of South Australia

Curated by ChEMBL


Assay Description
Inhibition of recombinant GST-tagged MNK1 (unknown origin) using eIF4E-derived peptide as substrate in presence of ATP at km concentration by ADP-Glo...


Bioorg Med Chem Lett 29: 2650-2654 (2019)


Article DOI: 10.1016/j.bmcl.2019.07.043
BindingDB Entry DOI: 10.7270/Q2B56P2W
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50611454
PNG
(CHEMBL5277074)
Show SMILES Cn1cc(cn1)-c1nc(Nc2cccc(c2)S(N)(=O)=O)ncc1Cl
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Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50611451
PNG
(CHEMBL5286978)
Show SMILES Cn1cc(cn1)-c1nc(Nc2cccc(c2)S(N)(=O)=O)ncc1F
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Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50611456
PNG
(CHEMBL5281179)
Show SMILES Cn1cc(cn1)-c1nc(Nc2ccc(cc2)S(C)(=O)=O)ncc1Cl
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Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50611452
PNG
(CHEMBL5286271)
Show SMILES Cn1cc(cn1)-c1nc(Nc2ccc(cc2)S(N)(=O)=O)ncc1F
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Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3


(Homo sapiens (Human))
BDBM50277601
PNG
(CHEMBL4167646)
Show SMILES COc1ccc(Nc2nccc(n2)-c2sc(SCCN(C)C)nc2C)c(OC)c1
Show InChI InChI=1S/C20H25N5O2S2/c1-13-18(29-20(22-13)28-11-10-25(2)3)16-8-9-21-19(24-16)23-15-7-6-14(26-4)12-17(15)27-5/h6-9,12H,10-11H2,1-5H3,(H,21,23,24)
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7n/an/an/an/an/an/an/an/a



University of South Australia

Curated by ChEMBL


Assay Description
Inhibition of recombinant human FLT3 using EAIYAAPFAKKK as substrate by ATP-Glo assay


Eur J Med Chem 139: 762-772 (2017)


Article DOI: 10.1016/j.ejmech.2017.08.006
BindingDB Entry DOI: 10.7270/Q24B33VW
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50611456
PNG
(CHEMBL5281179)
Show SMILES Cn1cc(cn1)-c1nc(Nc2ccc(cc2)S(C)(=O)=O)ncc1Cl
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Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50611457
PNG
(CHEMBL5285230)
Show SMILES Cn1cc(cn1)-c1nc(NC2CCN(CC2)S(C)(=O)=O)ncc1Cl
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Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50611457
PNG
(CHEMBL5285230)
Show SMILES Cn1cc(cn1)-c1nc(NC2CCN(CC2)S(C)(=O)=O)ncc1Cl
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Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50611459
PNG
(CHEMBL5277565)
Show SMILES Cc1nn(C)cc1-c1nc(NC2CCN(CC2)S(C)(=O)=O)ncc1Cl
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Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50611459
PNG
(CHEMBL5277565)
Show SMILES Cc1nn(C)cc1-c1nc(NC2CCN(CC2)S(C)(=O)=O)ncc1Cl
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Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50611455
PNG
(CHEMBL5286090)
Show SMILES Cn1cc(cn1)-c1nc(Nc2ccc(cc2)S(N)(=O)=O)ncc1Cl
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Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50611458
PNG
(CHEMBL5286293)
Show SMILES Cn1cc(cn1)-c1nc(NC2CCN(CC2)S(C)(=O)=O)ncc1F
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18n/an/an/an/an/an/an/an/a


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Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50611452
PNG
(CHEMBL5286271)
Show SMILES Cn1cc(cn1)-c1nc(Nc2ccc(cc2)S(N)(=O)=O)ncc1F
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More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50611452
PNG
(CHEMBL5286271)
Show SMILES Cn1cc(cn1)-c1nc(Nc2ccc(cc2)S(N)(=O)=O)ncc1F
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21n/an/an/an/an/an/an/an/a


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More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50611451
PNG
(CHEMBL5286978)
Show SMILES Cn1cc(cn1)-c1nc(Nc2cccc(c2)S(N)(=O)=O)ncc1F
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More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50611457
PNG
(CHEMBL5285230)
Show SMILES Cn1cc(cn1)-c1nc(NC2CCN(CC2)S(C)(=O)=O)ncc1Cl
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Citation and Details
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50611451
PNG
(CHEMBL5286978)
Show SMILES Cn1cc(cn1)-c1nc(Nc2cccc(c2)S(N)(=O)=O)ncc1F
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More data for this
Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3


(Homo sapiens (Human))
BDBM50277603
PNG
(CHEMBL4167329)
Show SMILES COc1ccc(Nc2nccc(n2)-c2sc(SCCCN(C)C)nc2C)c(OC)c1
Show InChI InChI=1S/C21H27N5O2S2/c1-14-19(30-21(23-14)29-12-6-11-26(2)3)17-9-10-22-20(25-17)24-16-8-7-15(27-4)13-18(16)28-5/h7-10,13H,6,11-12H2,1-5H3,(H,22,24,25)
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30n/an/an/an/an/an/an/an/a



University of South Australia

Curated by ChEMBL


Assay Description
Inhibition of recombinant human FLT3 using EAIYAAPFAKKK as substrate by ATP-Glo assay


Eur J Med Chem 139: 762-772 (2017)


Article DOI: 10.1016/j.ejmech.2017.08.006
BindingDB Entry DOI: 10.7270/Q24B33VW
More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 1


(Homo sapiens (Human))
BDBM50512740
PNG
(CHEMBL4449736)
Show SMILES Clc1cc(Nc2ccncc2)c(=O)n2c1C(=O)NC21CCCCC1
Show InChI InChI=1S/C17H17ClN4O2/c18-12-10-13(20-11-4-8-19-9-5-11)16(24)22-14(12)15(23)21-17(22)6-2-1-3-7-17/h4-5,8-10H,1-3,6-7H2,(H,19,20)(H,21,23)
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32n/an/an/an/an/an/an/an/a



University of South Australia

Curated by ChEMBL


Assay Description
Inhibition of recombinant GST-tagged MNK1 (unknown origin) using eIF4E-derived peptide as substrate in presence of ATP at km concentration by ADP-Glo...


Bioorg Med Chem Lett 29: 2650-2654 (2019)


Article DOI: 10.1016/j.bmcl.2019.07.043
BindingDB Entry DOI: 10.7270/Q2B56P2W
More data for this
Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3


(Homo sapiens (Human))
BDBM50277602
PNG
(CHEMBL4164283)
Show SMILES CNc1nc(C)c(s1)-c1ccnc(Nc2ccc(OC)cc2OC)n1
Show InChI InChI=1S/C17H19N5O2S/c1-10-15(25-17(18-2)20-10)13-7-8-19-16(22-13)21-12-6-5-11(23-3)9-14(12)24-4/h5-9H,1-4H3,(H,18,20)(H,19,21,22)
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32n/an/an/an/an/an/an/an/a



University of South Australia

Curated by ChEMBL


Assay Description
Inhibition of recombinant human FLT3 using EAIYAAPFAKKK as substrate by ATP-Glo assay


Eur J Med Chem 139: 762-772 (2017)


Article DOI: 10.1016/j.ejmech.2017.08.006
BindingDB Entry DOI: 10.7270/Q24B33VW
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50611455
PNG
(CHEMBL5286090)
Show SMILES Cn1cc(cn1)-c1nc(Nc2ccc(cc2)S(N)(=O)=O)ncc1Cl
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33n/an/an/an/an/an/an/an/a


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Citation and Details
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50611456
PNG
(CHEMBL5281179)
Show SMILES Cn1cc(cn1)-c1nc(Nc2ccc(cc2)S(C)(=O)=O)ncc1Cl
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Citation and Details
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50611458
PNG
(CHEMBL5286293)
Show SMILES Cn1cc(cn1)-c1nc(NC2CCN(CC2)S(C)(=O)=O)ncc1F
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Citation and Details
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50611453
PNG
(CHEMBL5270069)
Show SMILES Cn1cc(cn1)-c1nc(Nc2ccc(cc2)S(C)(=O)=O)ncc1F
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42n/an/an/an/an/an/an/an/a


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More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM50512741
PNG
(CHEMBL4466664)
Show SMILES Clc1cc(Nc2ccon2)c(=O)n2c1C(=O)NC21CCCCC1
Show InChI InChI=1S/C15H15ClN4O3/c16-9-8-10(17-11-4-7-23-19-11)14(22)20-12(9)13(21)18-15(20)5-2-1-3-6-15/h4,7-8H,1-3,5-6H2,(H,17,19)(H,18,21)
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43n/an/an/an/an/an/an/an/a



University of South Australia

Curated by ChEMBL


Assay Description
Inhibition of recombinant His-tagged MNK2 (unknown origin) using eIF4E-derived peptide as substrate in presence of ATP at Km concentration by ADP-Glo...


Bioorg Med Chem Lett 29: 2650-2654 (2019)


Article DOI: 10.1016/j.bmcl.2019.07.043
BindingDB Entry DOI: 10.7270/Q2B56P2W
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50113281
PNG
(AT-7519)
Show SMILES Clc1cccc(Cl)c1C(=O)Nc1c[nH]nc1C(=O)NC1CCNCC1
Show InChI InChI=1S/C16H17Cl2N5O2/c17-10-2-1-3-11(18)13(10)15(24)22-12-8-20-23-14(12)16(25)21-9-4-6-19-7-5-9/h1-3,8-9,19H,4-7H2,(H,20,23)(H,21,25)(H,22,24)
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47n/an/an/an/an/an/an/an/a


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Citation and Details
More data for this
Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3


(Homo sapiens (Human))
BDBM50277648
PNG
(CHEMBL4159419)
Show SMILES COc1ccc(Nc2nccc(n2)-c2sc(SCc3cccnc3)nc2C)c(OC)c1
Show InChI InChI=1S/C22H21N5O2S2/c1-14-20(31-22(25-14)30-13-15-5-4-9-23-12-15)18-8-10-24-21(27-18)26-17-7-6-16(28-2)11-19(17)29-3/h4-12H,13H2,1-3H3,(H,24,26,27)
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60n/an/an/an/an/an/an/an/a



University of South Australia

Curated by ChEMBL


Assay Description
Binding affinity determined against ETA receptor in porcine aortic smooth muscle membrane


Eur J Med Chem 139: 762-772 (2017)


Article DOI: 10.1016/j.ejmech.2017.08.006
BindingDB Entry DOI: 10.7270/Q24B33VW
More data for this
Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3


(Homo sapiens (Human))
BDBM50277618
PNG
(CHEMBL4165526)
Show SMILES Oc1ccccc1Nc1nccc(n1)-c1c[nH]c2ccccc12
Show InChI InChI=1S/C18H14N4O/c23-17-8-4-3-7-16(17)22-18-19-10-9-15(21-18)13-11-20-14-6-2-1-5-12(13)14/h1-11,20,23H,(H,19,21,22)
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63n/an/an/an/an/an/an/an/a



University of South Australia

Curated by ChEMBL


Assay Description
Inhibition of recombinant human FLT3 using EAIYAAPFAKKK as substrate by ATP-Glo assay


Eur J Med Chem 139: 762-772 (2017)


Article DOI: 10.1016/j.ejmech.2017.08.006
BindingDB Entry DOI: 10.7270/Q24B33VW
More data for this
Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3


(Homo sapiens (Human))
BDBM50277604
PNG
(CHEMBL4159742)
Show SMILES COCCSc1nc(C)c(s1)-c1ccnc(Nc2ccc(OC)cc2OC)n1
Show InChI InChI=1S/C19H22N4O3S2/c1-12-17(28-19(21-12)27-10-9-24-2)15-7-8-20-18(23-15)22-14-6-5-13(25-3)11-16(14)26-4/h5-8,11H,9-10H2,1-4H3,(H,20,22,23)
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64n/an/an/an/an/an/an/an/a



University of South Australia

Curated by ChEMBL


Assay Description
Inhibition of recombinant human FLT3 using EAIYAAPFAKKK as substrate by ATP-Glo assay


Eur J Med Chem 139: 762-772 (2017)


Article DOI: 10.1016/j.ejmech.2017.08.006
BindingDB Entry DOI: 10.7270/Q24B33VW
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50611460
PNG
(CHEMBL5277367)
Show SMILES Cn1cc(cn1)-c1nc(Nc2ccc(cc2)S(=O)(=O)C(F)(F)F)ncc1F
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70n/an/an/an/an/an/an/an/a


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More data for this
Ligand-Target Pair
MAP kinase-interacting serine/threonine-protein kinase 1


(Homo sapiens (Human))
BDBM50512739
PNG
(CHEMBL4535537)
Show SMILES Fc1cnccc1Nc1cc(Cl)c2C(=O)NC3(CCCCC3)n2c1=O
Show InChI InChI=1S/C17H16ClFN4O2/c18-10-8-13(21-12-4-7-20-9-11(12)19)16(25)23-14(10)15(24)22-17(23)5-2-1-3-6-17/h4,7-9H,1-3,5-6H2,(H,20,21)(H,22,24)
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76n/an/an/an/an/an/an/an/a



University of South Australia

Curated by ChEMBL


Assay Description
Inhibition of recombinant GST-tagged MNK1 (unknown origin) using eIF4E-derived peptide as substrate in presence of ATP at km concentration by ADP-Glo...


Bioorg Med Chem Lett 29: 2650-2654 (2019)


Article DOI: 10.1016/j.bmcl.2019.07.043
BindingDB Entry DOI: 10.7270/Q2B56P2W
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor alpha/beta


(Mus musculus (mouse))
BDBM50611451
PNG
(CHEMBL5286978)
Show SMILES Cn1cc(cn1)-c1nc(Nc2cccc(c2)S(N)(=O)=O)ncc1F
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77n/an/an/an/an/an/an/an/a


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Ligand-Target Pair
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