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PubMed code 30615446

Compile data set for download or QSAR
Found 69 hits of Enzyme Inhibition Constant Data   
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
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508392
PNG
(CHEMBL4435664)
Show SMILES FC(F)(F)c1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCN(CC1)C(=O)C=C |t:11|
Show InChI InChI=1S/C26H21F3N4O3/c1-2-21(34)33-11-9-32(10-12-33)15-7-8-19(26(27,28)29)17(13-15)22-23(25(36)31-24(22)35)18-14-30-20-6-4-3-5-16(18)20/h2-8,13-14,30H,1,9-12H2,(H,31,35,36)
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 1n/an/an/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508386
PNG
(CHEMBL4450627)
Show SMILES [O-][N+](=O)c1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCN(CC1)C(=O)C=C |t:10|
Show InChI InChI=1S/C25H21N5O5/c1-2-21(31)29-11-9-28(10-12-29)15-7-8-20(30(34)35)17(13-15)22-23(25(33)27-24(22)32)18-14-26-19-6-4-3-5-16(18)19/h2-8,13-14,26H,1,9-12H2,(H,27,32,33)
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 1.10n/an/an/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508391
PNG
(CHEMBL4470305)
Show SMILES Clc1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCN(CC1)C(=O)C=C |t:8|
Show InChI InChI=1S/C25H21ClN4O3/c1-2-21(31)30-11-9-29(10-12-30)15-7-8-19(26)17(13-15)22-23(25(33)28-24(22)32)18-14-27-20-6-4-3-5-16(18)20/h2-8,13-14,27H,1,9-12H2,(H,28,32,33)
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 3.30n/an/an/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508381
PNG
(CHEMBL4454565)
Show SMILES CN(CCNC(=O)C=C)c1ccc(c(c1)C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)C(F)(F)F |t:16|
Show InChI InChI=1S/C25H21F3N4O3/c1-3-20(33)29-10-11-32(2)14-8-9-18(25(26,27)28)16(12-14)21-22(24(35)31-23(21)34)17-13-30-19-7-5-4-6-15(17)19/h3-9,12-13,30H,1,10-11H2,2H3,(H,29,33)(H,31,34,35)
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 9.40n/an/an/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508382
PNG
(CHEMBL4533508)
Show SMILES FC(F)(F)c1ccc(NC2CCN(CC2)C(=O)C=C)cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12 |t:23|
Show InChI InChI=1S/C27H23F3N4O3/c1-2-22(35)34-11-9-15(10-12-34)32-16-7-8-20(27(28,29)30)18(13-16)23-24(26(37)33-25(23)36)19-14-31-21-6-4-3-5-17(19)21/h2-8,13-15,31-32H,1,9-12H2,(H,33,36,37)
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 27n/an/an/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508390
PNG
(CHEMBL4445411)
Show SMILES Cc1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCN(CC1)C(=O)C=C |t:8|
Show InChI InChI=1S/C26H24N4O3/c1-3-22(31)30-12-10-29(11-13-30)17-9-8-16(2)19(14-17)23-24(26(33)28-25(23)32)20-15-27-21-7-5-4-6-18(20)21/h3-9,14-15,27H,1,10-13H2,2H3,(H,28,32,33)
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 51n/an/an/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508407
PNG
(CHEMBL4543011)
Show SMILES FC(F)(F)c1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCN(CC1)C(=O)C#C |t:11|
Show InChI InChI=1S/C26H19F3N4O3/c1-2-21(34)33-11-9-32(10-12-33)15-7-8-19(26(27,28)29)17(13-15)22-23(25(36)31-24(22)35)18-14-30-20-6-4-3-5-16(18)20/h1,3-8,13-14,30H,9-12H2,(H,31,35,36)
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 55n/an/an/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508389
PNG
(CHEMBL4444559)
Show SMILES FC(F)(F)c1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCC[C@H](C1)NC(=O)C=C |r,t:11|
Show InChI InChI=1S/C27H23F3N4O3/c1-2-22(35)32-15-6-5-11-34(14-15)16-9-10-20(27(28,29)30)18(12-16)23-24(26(37)33-25(23)36)19-13-31-21-8-4-3-7-17(19)21/h2-4,7-10,12-13,15,31H,1,5-6,11,14H2,(H,32,35)(H,33,36,37)/t15-/m1/s1
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 201n/an/an/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508411
PNG
(CHEMBL4473956)
Show SMILES [O-][N+](=O)c1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCN(CC1)C(=O)C#C |t:10|
Show InChI InChI=1S/C25H19N5O5/c1-2-21(31)29-11-9-28(10-12-29)15-7-8-20(30(34)35)17(13-15)22-23(25(33)27-24(22)32)18-14-26-19-6-4-3-5-16(18)19/h1,3-8,13-14,26H,9-12H2,(H,27,32,33)
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n/an/a<0.100n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508383
PNG
(CHEMBL4463109)
Show SMILES FC(F)(F)c1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCN(CC1)C(=O)CCl |t:11|
Show InChI InChI=1S/C25H20ClF3N4O3/c26-12-20(34)33-9-7-32(8-10-33)14-5-6-18(25(27,28)29)16(11-14)21-22(24(36)31-23(21)35)17-13-30-19-4-2-1-3-15(17)19/h1-6,11,13,30H,7-10,12H2,(H,31,35,36)
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n/an/a 0.400n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508403
PNG
(CHEMBL4464668)
Show SMILES CN(CCCNC(=O)C=C)c1ccc(c(c1)C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)[N+]([O-])=O |t:17|
Show InChI InChI=1S/C25H23N5O5/c1-3-21(31)26-11-6-12-29(2)15-9-10-20(30(34)35)17(13-15)22-23(25(33)28-24(22)32)18-14-27-19-8-5-4-7-16(18)19/h3-5,7-10,13-14,27H,1,6,11-12H2,2H3,(H,26,31)(H,28,32,33)
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n/an/a 0.400n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508386
PNG
(CHEMBL4450627)
Show SMILES [O-][N+](=O)c1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCN(CC1)C(=O)C=C |t:10|
Show InChI InChI=1S/C25H21N5O5/c1-2-21(31)29-11-9-28(10-12-29)15-7-8-20(30(34)35)17(13-15)22-23(25(33)27-24(22)32)18-14-26-19-6-4-3-5-16(18)19/h2-8,13-14,26H,1,9-12H2,(H,27,32,33)
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n/an/a 0.400n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM209866
PNG
(PF-06651600 | US11111242, Example 5 | US2023034848...)
Show SMILES C[C@H]1CC[C@H](CN1C(=O)C=C)Nc1ncnc2[nH]ccc12 |r|
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UniChem
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n/an/a 0.400n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508384
PNG
(CHEMBL4578121)
Show SMILES CN(CCCNC(=O)C=C)c1ccc(c(c1)C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)C(F)(F)F |t:17|
Show InChI InChI=1S/C26H23F3N4O3/c1-3-21(34)30-11-6-12-33(2)15-9-10-19(26(27,28)29)17(13-15)22-23(25(36)32-24(22)35)18-14-31-20-8-5-4-7-16(18)20/h3-5,7-10,13-14,31H,1,6,11-12H2,2H3,(H,30,34)(H,32,35,36)
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n/an/a 0.600n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508381
PNG
(CHEMBL4454565)
Show SMILES CN(CCNC(=O)C=C)c1ccc(c(c1)C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)C(F)(F)F |t:16|
Show InChI InChI=1S/C25H21F3N4O3/c1-3-20(33)29-10-11-32(2)14-8-9-18(25(26,27)28)16(12-14)21-22(24(35)31-23(21)34)17-13-30-19-7-5-4-6-15(17)19/h3-9,12-13,30H,1,10-11H2,2H3,(H,29,33)(H,31,34,35)
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n/an/a 0.600n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508407
PNG
(CHEMBL4543011)
Show SMILES FC(F)(F)c1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCN(CC1)C(=O)C#C |t:11|
Show InChI InChI=1S/C26H19F3N4O3/c1-2-21(34)33-11-9-32(10-12-33)15-7-8-19(26(27,28)29)17(13-15)22-23(25(36)31-24(22)35)18-14-30-20-6-4-3-5-16(18)20/h1,3-8,13-14,30H,9-12H2,(H,31,35,36)
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n/an/a 0.800n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508392
PNG
(CHEMBL4435664)
Show SMILES FC(F)(F)c1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCN(CC1)C(=O)C=C |t:11|
Show InChI InChI=1S/C26H21F3N4O3/c1-2-21(34)33-11-9-32(10-12-33)15-7-8-19(26(27,28)29)17(13-15)22-23(25(36)31-24(22)35)18-14-30-20-6-4-3-5-16(18)20/h2-8,13-14,30H,1,9-12H2,(H,31,35,36)
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n/an/a 1.5n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50193995
PNG
(3-((3R,4R)-4-methyl-3-(methyl(7H-pyrrolo[2,3-d]pyr...)
Show SMILES C[C@@H]1CCN(C[C@@H]1N(C)c1ncnc2[nH]ccc12)C(=O)CC#N |r|
Show InChI InChI=1S/C16H20N6O/c1-11-5-8-22(14(23)3-6-17)9-13(11)21(2)16-12-4-7-18-15(12)19-10-20-16/h4,7,10-11,13H,3,5,8-9H2,1-2H3,(H,18,19,20)/t11-,13+/m1/s1
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n/an/a 1.70n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508397
PNG
(CHEMBL4461890)
Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2cc(ccc2C(F)(F)F)N2CCN(CC2)C(=O)C=C)c2ccccc12 |t:4|
Show InChI InChI=1S/C27H23F3N4O3/c1-3-22(35)34-12-10-33(11-13-34)16-8-9-20(27(28,29)30)18(14-16)23-24(26(37)31-25(23)36)19-15-32(2)21-7-5-4-6-17(19)21/h3-9,14-15H,1,10-13H2,2H3,(H,31,36,37)
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n/an/a 2n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50335231
PNG
(3-{5-[4-(2-Hydroxy-2-methyl-propionyl)-piperazin-1...)
Show SMILES CC(C)(O)C(=O)N1CCN(CC1)c1ccc(c(c1)C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)C(F)(F)F |t:20|
Show InChI InChI=1S/C27H25F3N4O4/c1-26(2,38)25(37)34-11-9-33(10-12-34)15-7-8-19(27(28,29)30)17(13-15)21-22(24(36)32-23(21)35)18-14-31-20-6-4-3-5-16(18)20/h3-8,13-14,31,38H,9-12H2,1-2H3,(H,32,35,36)
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n/an/a 2n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508398
PNG
(CHEMBL4444087)
Show SMILES Fc1ccc2c(c[nH]c2c1)C1=C(C(=O)NC1=O)c1cc(ccc1C(F)(F)F)N1CCN(CC1)C(=O)C=C |t:12|
Show InChI InChI=1S/C26H20F4N4O3/c1-2-21(35)34-9-7-33(8-10-34)15-4-6-19(26(28,29)30)17(12-15)22-23(25(37)32-24(22)36)18-13-31-20-11-14(27)3-5-16(18)20/h2-6,11-13,31H,1,7-10H2,(H,32,36,37)
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n/an/a 2.80n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508400
PNG
(CHEMBL4522075)
Show SMILES FC(F)(F)c1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ncccc12)N1CCN(CC1)C(=O)C=C |t:11|
Show InChI InChI=1S/C25H20F3N5O3/c1-2-19(34)33-10-8-32(9-11-33)14-5-6-18(25(26,27)28)16(12-14)20-21(24(36)31-23(20)35)17-13-30-22-15(17)4-3-7-29-22/h2-7,12-13H,1,8-11H2,(H,29,30)(H,31,35,36)
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n/an/a 4n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508391
PNG
(CHEMBL4470305)
Show SMILES Clc1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCN(CC1)C(=O)C=C |t:8|
Show InChI InChI=1S/C25H21ClN4O3/c1-2-21(31)30-11-9-29(10-12-30)15-7-8-19(26)17(13-15)22-23(25(33)28-24(22)32)18-14-27-20-6-4-3-5-16(18)20/h2-8,13-14,27H,1,9-12H2,(H,28,32,33)
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n/an/a 4.30n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508393
PNG
(CHEMBL4464446)
Show SMILES CN(C1CCN(C1)c1ccc(c(c1)C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)C(F)(F)F)C(=O)C=C |t:15|
Show InChI InChI=1S/C27H23F3N4O3/c1-3-22(35)33(2)16-10-11-34(14-16)15-8-9-20(27(28,29)30)18(12-15)23-24(26(37)32-25(23)36)19-13-31-21-7-5-4-6-17(19)21/h3-9,12-13,16,31H,1,10-11,14H2,2H3,(H,32,36,37)
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n/an/a 4.40n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508399
PNG
(CHEMBL4441142)
Show SMILES Fc1ccc2[nH]cc(C3=C(C(=O)NC3=O)c3cc(ccc3C(F)(F)F)N3CCN(CC3)C(=O)C=C)c2c1 |t:8|
Show InChI InChI=1S/C26H20F4N4O3/c1-2-21(35)34-9-7-33(8-10-34)15-4-5-19(26(28,29)30)17(12-15)22-23(25(37)32-24(22)36)18-13-31-20-6-3-14(27)11-16(18)20/h2-6,11-13,31H,1,7-10H2,(H,32,36,37)
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n/an/a 5.40n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508388
PNG
(CHEMBL4541648)
Show SMILES CCC(=O)N1CCN(CC1)c1ccc(c(c1)C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)[N+]([O-])=O |t:18|
Show InChI InChI=1S/C25H23N5O5/c1-2-21(31)29-11-9-28(10-12-29)15-7-8-20(30(34)35)17(13-15)22-23(25(33)27-24(22)32)18-14-26-19-6-4-3-5-16(18)19/h3-8,13-14,26H,2,9-12H2,1H3,(H,27,32,33)
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n/an/a 6n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508382
PNG
(CHEMBL4533508)
Show SMILES FC(F)(F)c1ccc(NC2CCN(CC2)C(=O)C=C)cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12 |t:23|
Show InChI InChI=1S/C27H23F3N4O3/c1-2-22(35)34-11-9-15(10-12-34)32-16-7-8-20(27(28,29)30)18(13-16)23-24(26(37)33-25(23)36)19-14-31-21-6-4-3-5-17(19)21/h2-8,13-15,31-32H,1,9-12H2,(H,33,36,37)
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n/an/a 6.40n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508385
PNG
(CHEMBL4459688)
Show SMILES Cc1ccc2c(c[nH]c2c1)C1=C(C(=O)NC1=O)c1cc(ccc1C(F)(F)F)N1CCN(CC1)C(=O)C=C |t:12|
Show InChI InChI=1S/C27H23F3N4O3/c1-3-22(35)34-10-8-33(9-11-34)16-5-7-20(27(28,29)30)18(13-16)23-24(26(37)32-25(23)36)19-14-31-21-12-15(2)4-6-17(19)21/h3-7,12-14,31H,1,8-11H2,2H3,(H,32,36,37)
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n/an/a 7.5n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508395
PNG
(CHEMBL4461660)
Show SMILES CN(CCCCNC(=O)C=C)c1ccc(c(c1)C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)C(F)(F)F |t:18|
Show InChI InChI=1S/C27H25F3N4O3/c1-3-22(35)31-12-6-7-13-34(2)16-10-11-20(27(28,29)30)18(14-16)23-24(26(37)33-25(23)36)19-15-32-21-9-5-4-8-17(19)21/h3-5,8-11,14-15,32H,1,6-7,12-13H2,2H3,(H,31,35)(H,33,36,37)
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n/an/a 16n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508406
PNG
(CHEMBL4439785)
Show SMILES FC(F)(F)c1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCN(CC1)C(=O)CBr |t:11|
Show InChI InChI=1S/C25H20BrF3N4O3/c26-12-20(34)33-9-7-32(8-10-33)14-5-6-18(25(27,28)29)16(11-14)21-22(24(36)31-23(21)35)17-13-30-19-4-2-1-3-15(17)19/h1-6,11,13,30H,7-10,12H2,(H,31,35,36)
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n/an/a 19n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508396
PNG
(CHEMBL4520141)
Show SMILES CN(C)C\C=C\C(=O)N1CCN(CC1)c1ccc(c(c1)C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)C(F)(F)F |t:22|
Show InChI InChI=1S/C29H28F3N5O3/c1-35(2)11-5-8-24(38)37-14-12-36(13-15-37)18-9-10-22(29(30,31)32)20(16-18)25-26(28(40)34-27(25)39)21-17-33-23-7-4-3-6-19(21)23/h3-10,16-17,33H,11-15H2,1-2H3,(H,34,39,40)/b8-5+
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n/an/a 21n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508394
PNG
(CHEMBL4463237)
Show SMILES FC(F)(F)c1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCC[C@@H](C1)NC(=O)C=C |r,t:11|
Show InChI InChI=1S/C27H23F3N4O3/c1-2-22(35)32-15-6-5-11-34(14-15)16-9-10-20(27(28,29)30)18(12-16)23-24(26(37)33-25(23)36)19-13-31-21-8-4-3-7-17(19)21/h2-4,7-10,12-13,15,31H,1,5-6,11,14H2,(H,32,35)(H,33,36,37)/t15-/m0/s1
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n/an/a 21n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508390
PNG
(CHEMBL4445411)
Show SMILES Cc1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCN(CC1)C(=O)C=C |t:8|
Show InChI InChI=1S/C26H24N4O3/c1-3-22(31)30-12-10-29(11-13-30)17-9-8-16(2)19(14-17)23-24(26(33)28-25(23)32)20-15-27-21-7-5-4-6-18(20)21/h3-9,14-15,27H,1,10-13H2,2H3,(H,28,32,33)
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n/an/a 21n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508389
PNG
(CHEMBL4444559)
Show SMILES FC(F)(F)c1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCC[C@H](C1)NC(=O)C=C |r,t:11|
Show InChI InChI=1S/C27H23F3N4O3/c1-2-22(35)32-15-6-5-11-34(14-15)16-9-10-20(27(28,29)30)18(12-16)23-24(26(37)33-25(23)36)19-13-31-21-8-4-3-7-17(19)21/h2-4,7-10,12-13,15,31H,1,5-6,11,14H2,(H,32,35)(H,33,36,37)/t15-/m1/s1
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n/an/a 21n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508405
PNG
(CHEMBL4554336)
Show SMILES CCC(=O)N1CCN(CC1)c1ccc(c(c1)C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)C(F)(F)F |t:18|
Show InChI InChI=1S/C26H23F3N4O3/c1-2-21(34)33-11-9-32(10-12-33)15-7-8-19(26(27,28)29)17(13-15)22-23(25(36)31-24(22)35)18-14-30-20-6-4-3-5-16(18)20/h3-8,13-14,30H,2,9-12H2,1H3,(H,31,35,36)
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n/an/a 27n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508409
PNG
(CHEMBL4513304)
Show SMILES FC(F)(F)c1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCN(CC1)C(=O)CNC(=O)C=C |t:11|
Show InChI InChI=1S/C28H24F3N5O4/c1-2-22(37)33-15-23(38)36-11-9-35(10-12-36)16-7-8-20(28(29,30)31)18(13-16)24-25(27(40)34-26(24)39)19-14-32-21-6-4-3-5-17(19)21/h2-8,13-14,32H,1,9-12,15H2,(H,33,37)(H,34,39,40)
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Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50193995
PNG
(3-((3R,4R)-4-methyl-3-(methyl(7H-pyrrolo[2,3-d]pyr...)
Show SMILES C[C@@H]1CCN(C[C@@H]1N(C)c1ncnc2[nH]ccc12)C(=O)CC#N |r|
Show InChI InChI=1S/C16H20N6O/c1-11-5-8-22(14(23)3-6-17)9-13(11)21(2)16-12-4-7-18-15(12)19-10-20-16/h4,7,10-11,13H,3,5,8-9H2,1-2H3,(H,18,19,20)/t11-,13+/m1/s1
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n/an/a 50n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 1 mM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508402
PNG
(CHEMBL4463762)
Show SMILES COc1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCN(CC1)C(=O)C=C |t:9|
Show InChI InChI=1S/C26H24N4O4/c1-3-22(31)30-12-10-29(11-13-30)16-8-9-21(34-2)18(14-16)23-24(26(33)28-25(23)32)19-15-27-20-7-5-4-6-17(19)20/h3-9,14-15,27H,1,10-13H2,2H3,(H,28,32,33)
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n/an/a 52n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508386
PNG
(CHEMBL4450627)
Show SMILES [O-][N+](=O)c1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCN(CC1)C(=O)C=C |t:10|
Show InChI InChI=1S/C25H21N5O5/c1-2-21(31)29-11-9-28(10-12-29)15-7-8-20(30(34)35)17(13-15)22-23(25(33)27-24(22)32)18-14-26-19-6-4-3-5-16(18)19/h2-8,13-14,26H,1,9-12H2,(H,27,32,33)
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n/an/a 80n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 1 mM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508411
PNG
(CHEMBL4473956)
Show SMILES [O-][N+](=O)c1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCN(CC1)C(=O)C#C |t:10|
Show InChI InChI=1S/C25H19N5O5/c1-2-21(31)29-11-9-28(10-12-29)15-7-8-20(30(34)35)17(13-15)22-23(25(33)27-24(22)32)18-14-26-19-6-4-3-5-16(18)19/h1,3-8,13-14,26H,9-12H2,(H,27,32,33)
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n/an/a 90n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 1 mM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508412
PNG
(CHEMBL4544861)
Show SMILES C\C=C\C(=O)N1CCN(CC1)c1ccc(c(c1)C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)C(F)(F)F |t:19|
Show InChI InChI=1S/C27H23F3N4O3/c1-2-5-22(35)34-12-10-33(11-13-34)16-8-9-20(27(28,29)30)18(14-16)23-24(26(37)32-25(23)36)19-15-31-21-7-4-3-6-17(19)21/h2-9,14-15,31H,10-13H2,1H3,(H,32,36,37)/b5-2+
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n/an/a 104n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM209866
PNG
(PF-06651600 | US11111242, Example 5 | US2023034848...)
Show SMILES C[C@H]1CC[C@H](CN1C(=O)C=C)Nc1ncnc2[nH]ccc12 |r|
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n/an/a 202n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 1 mM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508388
PNG
(CHEMBL4541648)
Show SMILES CCC(=O)N1CCN(CC1)c1ccc(c(c1)C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)[N+]([O-])=O |t:18|
Show InChI InChI=1S/C25H23N5O5/c1-2-21(31)29-11-9-28(10-12-29)15-7-8-20(30(34)35)17(13-15)22-23(25(33)27-24(22)32)18-14-26-19-6-4-3-5-16(18)19/h3-8,13-14,26H,2,9-12H2,1H3,(H,27,32,33)
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n/an/a 210n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 1 mM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508383
PNG
(CHEMBL4463109)
Show SMILES FC(F)(F)c1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCN(CC1)C(=O)CCl |t:11|
Show InChI InChI=1S/C25H20ClF3N4O3/c26-12-20(34)33-9-7-32(8-10-33)14-5-6-18(25(27,28)29)16(11-14)21-22(24(36)31-23(21)35)17-13-30-19-4-2-1-3-15(17)19/h1-6,11,13,30H,7-10,12H2,(H,31,35,36)
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n/an/a 210n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 1 mM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508407
PNG
(CHEMBL4543011)
Show SMILES FC(F)(F)c1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCN(CC1)C(=O)C#C |t:11|
Show InChI InChI=1S/C26H19F3N4O3/c1-2-21(34)33-11-9-32(10-12-33)15-7-8-19(26(27,28)29)17(13-15)22-23(25(36)31-24(22)35)18-14-30-20-6-4-3-5-16(18)20/h1,3-8,13-14,30H,9-12H2,(H,31,35,36)
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n/an/a 212n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 1 mM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508410
PNG
(CHEMBL4557507)
Show SMILES C=CC(=O)N1CCN(CC1)c1cccc(c1)C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12 |t:18|
Show InChI InChI=1S/C25H22N4O3/c1-2-21(30)29-12-10-28(11-13-29)17-7-5-6-16(14-17)22-23(25(32)27-24(22)31)19-15-26-20-9-4-3-8-18(19)20/h2-9,14-15,26H,1,10-13H2,(H,27,31,32)
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n/an/a 232n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508403
PNG
(CHEMBL4464668)
Show SMILES CN(CCCNC(=O)C=C)c1ccc(c(c1)C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)[N+]([O-])=O |t:17|
Show InChI InChI=1S/C25H23N5O5/c1-3-21(31)26-11-6-12-29(2)15-9-10-20(30(34)35)17(13-15)22-23(25(33)28-24(22)32)18-14-27-19-8-5-4-7-16(18)19/h3-5,7-10,13-14,27H,1,6,11-12H2,2H3,(H,26,31)(H,28,32,33)
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n/an/a 332n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 1 mM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508391
PNG
(CHEMBL4470305)
Show SMILES Clc1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCN(CC1)C(=O)C=C |t:8|
Show InChI InChI=1S/C25H21ClN4O3/c1-2-21(31)30-11-9-29(10-12-30)15-7-8-19(26)17(13-15)22-23(25(33)28-24(22)32)18-14-27-20-6-4-3-5-16(18)20/h2-8,13-14,27H,1,9-12H2,(H,28,32,33)
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n/an/a 450n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 1 mM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508392
PNG
(CHEMBL4435664)
Show SMILES FC(F)(F)c1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCN(CC1)C(=O)C=C |t:11|
Show InChI InChI=1S/C26H21F3N4O3/c1-2-21(34)33-11-9-32(10-12-33)15-7-8-19(26(27,28)29)17(13-15)22-23(25(36)31-24(22)35)18-14-30-20-6-4-3-5-16(18)20/h2-8,13-14,30H,1,9-12H2,(H,31,35,36)
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n/an/a 520n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 1 mM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508397
PNG
(CHEMBL4461890)
Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2cc(ccc2C(F)(F)F)N2CCN(CC2)C(=O)C=C)c2ccccc12 |t:4|
Show InChI InChI=1S/C27H23F3N4O3/c1-3-22(35)34-12-10-33(11-13-34)16-8-9-20(27(28,29)30)18(14-16)23-24(26(37)31-25(23)36)19-15-32(2)21-7-5-4-6-17(19)21/h3-9,14-15H,1,10-13H2,2H3,(H,31,36,37)
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n/an/a 584n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 1 mM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508385
PNG
(CHEMBL4459688)
Show SMILES Cc1ccc2c(c[nH]c2c1)C1=C(C(=O)NC1=O)c1cc(ccc1C(F)(F)F)N1CCN(CC1)C(=O)C=C |t:12|
Show InChI InChI=1S/C27H23F3N4O3/c1-3-22(35)34-10-8-33(9-11-34)16-5-7-20(27(28,29)30)18(13-16)23-24(26(37)32-25(23)36)19-14-31-21-12-15(2)4-6-17(19)21/h3-7,12-14,31H,1,8-11H2,2H3,(H,32,36,37)
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n/an/a 650n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 1 mM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50335231
PNG
(3-{5-[4-(2-Hydroxy-2-methyl-propionyl)-piperazin-1...)
Show SMILES CC(C)(O)C(=O)N1CCN(CC1)c1ccc(c(c1)C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)C(F)(F)F |t:20|
Show InChI InChI=1S/C27H25F3N4O4/c1-26(2,38)25(37)34-11-9-33(10-12-34)15-7-8-19(27(28,29)30)17(13-15)21-22(24(36)32-23(21)35)18-14-31-20-6-4-3-5-16(18)20/h3-8,13-14,31,38H,9-12H2,1-2H3,(H,32,35,36)
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n/an/a 685n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 1 mM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508406
PNG
(CHEMBL4439785)
Show SMILES FC(F)(F)c1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCN(CC1)C(=O)CBr |t:11|
Show InChI InChI=1S/C25H20BrF3N4O3/c26-12-20(34)33-9-7-32(8-10-33)14-5-6-18(25(27,28)29)16(11-14)21-22(24(36)31-23(21)35)17-13-30-19-4-2-1-3-15(17)19/h1-6,11,13,30H,7-10,12H2,(H,31,35,36)
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n/an/a 709n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 1 mM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508400
PNG
(CHEMBL4522075)
Show SMILES FC(F)(F)c1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ncccc12)N1CCN(CC1)C(=O)C=C |t:11|
Show InChI InChI=1S/C25H20F3N5O3/c1-2-19(34)33-10-8-32(9-11-33)14-5-6-18(25(26,27)28)16(12-14)20-21(24(36)31-23(20)35)17-13-30-22-15(17)4-3-7-29-22/h2-7,12-13H,1,8-11H2,(H,29,30)(H,31,35,36)
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n/an/a 750n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 1 mM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508398
PNG
(CHEMBL4444087)
Show SMILES Fc1ccc2c(c[nH]c2c1)C1=C(C(=O)NC1=O)c1cc(ccc1C(F)(F)F)N1CCN(CC1)C(=O)C=C |t:12|
Show InChI InChI=1S/C26H20F4N4O3/c1-2-21(35)34-9-7-33(8-10-34)15-4-6-19(26(28,29)30)17(12-15)22-23(25(37)32-24(22)36)18-13-31-20-11-14(27)3-5-16(18)20/h2-6,11-13,31H,1,7-10H2,(H,32,36,37)
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n/an/a 817n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 1 mM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508387
PNG
(CHEMBL4537868)
Show SMILES Fc1ccc(cc1N1CCN(CC1)C(=O)C=C)C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12 |t:19|
Show InChI InChI=1S/C25H21FN4O3/c1-2-21(31)30-11-9-29(10-12-30)20-13-15(7-8-18(20)26)22-23(25(33)28-24(22)32)17-14-27-19-6-4-3-5-16(17)19/h2-8,13-14,27H,1,9-12H2,(H,28,32,33)
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n/an/a 873n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508408
PNG
(CHEMBL4461593)
Show SMILES FC(F)(F)c1cc(cc(c1)C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCN(CC1)C(=O)C=C |t:11|
Show InChI InChI=1S/C26H21F3N4O3/c1-2-21(34)33-9-7-32(8-10-33)17-12-15(11-16(13-17)26(27,28)29)22-23(25(36)31-24(22)35)19-14-30-20-6-4-3-5-18(19)20/h2-6,11-14,30H,1,7-10H2,(H,31,35,36)
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n/an/a 894n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508399
PNG
(CHEMBL4441142)
Show SMILES Fc1ccc2[nH]cc(C3=C(C(=O)NC3=O)c3cc(ccc3C(F)(F)F)N3CCN(CC3)C(=O)C=C)c2c1 |t:8|
Show InChI InChI=1S/C26H20F4N4O3/c1-2-21(35)34-9-7-33(8-10-34)15-4-5-19(26(28,29)30)17(12-15)22-23(25(37)32-24(22)36)18-13-31-20-6-3-14(27)11-16(18)20/h2-6,11-13,31H,1,7-10H2,(H,32,36,37)
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n/an/a 895n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 1 mM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508405
PNG
(CHEMBL4554336)
Show SMILES CCC(=O)N1CCN(CC1)c1ccc(c(c1)C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)C(F)(F)F |t:18|
Show InChI InChI=1S/C26H23F3N4O3/c1-2-21(34)33-11-9-32(10-12-33)15-7-8-19(26(27,28)29)17(13-15)22-23(25(36)31-24(22)35)18-14-30-20-6-4-3-5-16(18)20/h3-8,13-14,30H,2,9-12H2,1H3,(H,31,35,36)
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n/an/a 1.00E+3n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 1 mM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508384
PNG
(CHEMBL4578121)
Show SMILES CN(CCCNC(=O)C=C)c1ccc(c(c1)C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)C(F)(F)F |t:17|
Show InChI InChI=1S/C26H23F3N4O3/c1-3-21(34)30-11-6-12-33(2)15-9-10-19(26(27,28)29)17(13-15)22-23(25(36)32-24(22)35)18-14-31-20-8-5-4-7-16(18)20/h3-5,7-10,13-14,31H,1,6,11-12H2,2H3,(H,30,34)(H,32,35,36)
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n/an/a 1.28E+3n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 1 mM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508404
PNG
(CHEMBL4526325)
Show SMILES C=CC(=O)N1CCC(CC1)NC1=C(C(=O)NC1=O)c1c[nH]c2ccccc12 |t:12|
Show InChI InChI=1S/C20H20N4O3/c1-2-16(25)24-9-7-12(8-10-24)22-18-17(19(26)23-20(18)27)14-11-21-15-6-4-3-5-13(14)15/h2-6,11-12,21H,1,7-10H2,(H2,22,23,26,27)
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n/an/a 1.78E+3n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508382
PNG
(CHEMBL4533508)
Show SMILES FC(F)(F)c1ccc(NC2CCN(CC2)C(=O)C=C)cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12 |t:23|
Show InChI InChI=1S/C27H23F3N4O3/c1-2-22(35)34-11-9-15(10-12-34)32-16-7-8-20(27(28,29)30)18(13-16)23-24(26(37)33-25(23)36)19-14-31-21-6-4-3-5-17(19)21/h2-8,13-15,31-32H,1,9-12H2,(H,33,36,37)
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n/an/a 3.46E+3n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 1 mM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508389
PNG
(CHEMBL4444559)
Show SMILES FC(F)(F)c1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCC[C@H](C1)NC(=O)C=C |r,t:11|
Show InChI InChI=1S/C27H23F3N4O3/c1-2-22(35)32-15-6-5-11-34(14-15)16-9-10-20(27(28,29)30)18(12-16)23-24(26(37)33-25(23)36)19-13-31-21-8-4-3-7-17(19)21/h2-4,7-10,12-13,15,31H,1,5-6,11,14H2,(H,32,35)(H,33,36,37)/t15-/m1/s1
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n/an/a 3.69E+3n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 1 mM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508401
PNG
(CHEMBL4457521)
Show SMILES FC(F)(F)c1ccc(cc1C1=C(C(=O)NC1=O)c1ccc(Cl)cc1)N1CCN(CC1)C(=O)C=C |t:11|
Show InChI InChI=1S/C24H19ClF3N3O3/c1-2-19(32)31-11-9-30(10-12-31)16-7-8-18(24(26,27)28)17(13-16)21-20(22(33)29-23(21)34)14-3-5-15(25)6-4-14/h2-8,13H,1,9-12H2,(H,29,33,34)
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n/an/a 4.00E+3n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 6 uM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508394
PNG
(CHEMBL4463237)
Show SMILES FC(F)(F)c1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCC[C@@H](C1)NC(=O)C=C |r,t:11|
Show InChI InChI=1S/C27H23F3N4O3/c1-2-22(35)32-15-6-5-11-34(14-15)16-9-10-20(27(28,29)30)18(12-16)23-24(26(37)33-25(23)36)19-13-31-21-8-4-3-7-17(19)21/h2-4,7-10,12-13,15,31H,1,5-6,11,14H2,(H,32,35)(H,33,36,37)/t15-/m0/s1
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n/an/a>3.00E+4n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal His-tagged JAK3 (795 to 1124 residues) expressed in baculovirus expression system in presence of 1 mM ATP by HTRF assa...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50335231
PNG
(3-{5-[4-(2-Hydroxy-2-methyl-propionyl)-piperazin-1...)
Show SMILES CC(C)(O)C(=O)N1CCN(CC1)c1ccc(c(c1)C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)C(F)(F)F |t:20|
Show InChI InChI=1S/C27H25F3N4O4/c1-26(2,38)25(37)34-11-9-33(10-12-34)15-7-8-19(27(28,29)30)17(13-15)21-22(24(36)32-23(21)35)18-14-31-20-6-4-3-5-16(18)20/h3-8,13-14,31,38H,9-12H2,1-2H3,(H,32,35,36)
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n/an/an/an/a 1.04E+3n/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of JAK3 in human CTLL2 cells assessed as reduction in IL15-induced STAT5 phosphorylation preincubated for 2 hrs followed by IL15 stimulati...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508386
PNG
(CHEMBL4450627)
Show SMILES [O-][N+](=O)c1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCN(CC1)C(=O)C=C |t:10|
Show InChI InChI=1S/C25H21N5O5/c1-2-21(31)29-11-9-28(10-12-29)15-7-8-20(30(34)35)17(13-15)22-23(25(33)27-24(22)32)18-14-26-19-6-4-3-5-16(18)19/h2-8,13-14,26H,1,9-12H2,(H,27,32,33)
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n/an/an/an/a 305n/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of JAK3 in human CTLL2 cells assessed as reduction in IL2-induced STAT5 phosphorylation preincubated for 2 hrs followed by IL2 stimulation...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50335231
PNG
(3-{5-[4-(2-Hydroxy-2-methyl-propionyl)-piperazin-1...)
Show SMILES CC(C)(O)C(=O)N1CCN(CC1)c1ccc(c(c1)C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)C(F)(F)F |t:20|
Show InChI InChI=1S/C27H25F3N4O4/c1-26(2,38)25(37)34-11-9-33(10-12-34)15-7-8-19(27(28,29)30)17(13-15)21-22(24(36)32-23(21)35)18-14-31-20-6-4-3-5-16(18)20/h3-8,13-14,31,38H,9-12H2,1-2H3,(H,32,35,36)
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n/an/an/an/a 2.00E+3n/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of JAK3 in human CTLL2 cells assessed as reduction in IL2-induced STAT5 phosphorylation preincubated for 2 hrs followed by IL2 stimulation...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))		BDBM50508386
PNG
(CHEMBL4450627)
Show SMILES [O-][N+](=O)c1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCN(CC1)C(=O)C=C |t:10|
Show InChI InChI=1S/C25H21N5O5/c1-2-21(31)29-11-9-28(10-12-29)15-7-8-20(30(34)35)17(13-15)22-23(25(33)27-24(22)32)18-14-26-19-6-4-3-5-16(18)19/h2-8,13-14,26H,1,9-12H2,(H,27,32,33)
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n/an/an/an/a 141n/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of JAK3 in human CTLL2 cells assessed as reduction in IL15-induced STAT5 phosphorylation preincubated for 2 hrs followed by IL15 stimulati...

J Med Chem 62: 1054-1066 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01823
BindingDB Entry DOI: 10.7270/Q20G3PFP
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%