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Compile Data Set for Download or QSAR

Found 122 hits Enz. Inhib. hit(s) with all data for entry = 50043304   
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 JAK2


(Homo sapiens (Human))
BDBM50439017
PNG
(CHEMBL2420827)
Show SMILES Clc1cccc(Cl)c1C(=O)Nc1ccnc(Nc2ccncn2)c1
Show InChI InChI=1S/C16H11Cl2N5O/c17-11-2-1-3-12(18)15(11)16(24)22-10-4-7-20-14(8-10)23-13-5-6-19-9-21-13/h1-9H,(H2,19,20,21,22,23,24)
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20n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50434821
PNG
(CHEMBL2387224)
Show SMILES Clc1cccc(Cl)c1C(=O)Nc1ccnc(NC(=O)C2CC2)c1
Show InChI InChI=1S/C16H13Cl2N3O2/c17-11-2-1-3-12(18)14(11)16(23)20-10-6-7-19-13(8-10)21-15(22)9-4-5-9/h1-3,6-9H,4-5H2,(H2,19,20,21,22,23)
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28n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50439014
PNG
(CHEMBL2420829)
Show SMILES CCn1cc(Nc2cc(NC(=O)c3c(Cl)cccc3Cl)ccn2)cn1
Show InChI InChI=1S/C17H15Cl2N5O/c1-2-24-10-12(9-21-24)22-15-8-11(6-7-20-15)23-17(25)16-13(18)4-3-5-14(16)19/h3-10H,2H2,1H3,(H2,20,22,23,25)
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35n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50439011
PNG
(CHEMBL2420826)
Show SMILES Clc1cccc(Cl)c1C(=O)Nc1ccnc(Nc2cnccn2)c1
Show InChI InChI=1S/C16H11Cl2N5O/c17-11-2-1-3-12(18)15(11)16(24)22-10-4-5-20-13(8-10)23-14-9-19-6-7-21-14/h1-9H,(H2,20,21,22,23,24)
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55n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50439018
PNG
(CHEMBL2420831)
Show SMILES Clc1cccc(Cl)c1C(=O)Nc1cc[nH]c(=O)c1
Show InChI InChI=1S/C12H8Cl2N2O2/c13-8-2-1-3-9(14)11(8)12(18)16-7-4-5-15-10(17)6-7/h1-6H,(H2,15,16,17,18)
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60n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50439006
PNG
(CHEMBL2420828)
Show SMILES Clc1cccc(Cl)c1C(=O)Nc1ccnc(Nc2cccnn2)c1
Show InChI InChI=1S/C16H11Cl2N5O/c17-11-3-1-4-12(18)15(11)16(24)21-10-6-8-19-14(9-10)22-13-5-2-7-20-23-13/h1-9H,(H2,19,21,22,23,24)
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63n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50439012
PNG
(CHEMBL2420812)
Show SMILES CCNC(=O)Nc1cc(NC(=O)c2c(Cl)cccc2Cl)ccn1
Show InChI InChI=1S/C15H14Cl2N4O2/c1-2-18-15(23)21-12-8-9(6-7-19-12)20-14(22)13-10(16)4-3-5-11(13)17/h3-8H,2H2,1H3,(H3,18,19,20,21,22,23)
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70n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK1


(Homo sapiens (Human))
BDBM50434821
PNG
(CHEMBL2387224)
Show SMILES Clc1cccc(Cl)c1C(=O)Nc1ccnc(NC(=O)C2CC2)c1
Show InChI InChI=1S/C16H13Cl2N3O2/c17-11-2-1-3-12(18)14(11)16(23)20-10-6-7-19-13(8-10)21-15(22)9-4-5-9/h1-3,6-9H,4-5H2,(H2,19,20,21,22,23)
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84n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK1 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK1


(Homo sapiens (Human))
BDBM50439018
PNG
(CHEMBL2420831)
Show SMILES Clc1cccc(Cl)c1C(=O)Nc1cc[nH]c(=O)c1
Show InChI InChI=1S/C12H8Cl2N2O2/c13-8-2-1-3-9(14)11(8)12(18)16-7-4-5-15-10(17)6-7/h1-6H,(H2,15,16,17,18)
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100n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK1 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 9


(Homo sapiens (Human))
BDBM50434821
PNG
(CHEMBL2387224)
Show SMILES Clc1cccc(Cl)c1C(=O)Nc1ccnc(NC(=O)C2CC2)c1
Show InChI InChI=1S/C16H13Cl2N3O2/c17-11-2-1-3-12(18)14(11)16(23)20-10-6-7-19-13(8-10)21-15(22)9-4-5-9/h1-3,6-9H,4-5H2,(H2,19,20,21,22,23)
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111n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of CDK9 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50439007
PNG
(CHEMBL2420824)
Show SMILES Clc1cccc(Cl)c1C(=O)Nc1ccnc(Nc2ccccn2)c1
Show InChI InChI=1S/C17H12Cl2N4O/c18-12-4-3-5-13(19)16(12)17(24)22-11-7-9-21-15(10-11)23-14-6-1-2-8-20-14/h1-10H,(H2,20,21,22,23,24)
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130n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK1


(Homo sapiens (Human))
BDBM50439017
PNG
(CHEMBL2420827)
Show SMILES Clc1cccc(Cl)c1C(=O)Nc1ccnc(Nc2ccncn2)c1
Show InChI InChI=1S/C16H11Cl2N5O/c17-11-2-1-3-12(18)15(11)16(24)22-10-4-7-20-14(8-10)23-13-5-6-19-9-21-13/h1-9H,(H2,19,20,21,22,23,24)
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200n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK1 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50439005
PNG
(CHEMBL2420830)
Show SMILES Clc1cccc(Cl)c1C(=O)Nc1ccnc2[nH]ccc12
Show InChI InChI=1S/C14H9Cl2N3O/c15-9-2-1-3-10(16)12(9)14(20)19-11-5-7-18-13-8(11)4-6-17-13/h1-7H,(H2,17,18,19,20)
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230n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50439016
PNG
(CHEMBL2420832)
Show SMILES CCC(=O)Nc1cc(NC(=O)c2c(Cl)cccc2Cl)ccn1
Show InChI InChI=1S/C15H13Cl2N3O2/c1-2-13(21)20-12-8-9(6-7-18-12)19-15(22)14-10(16)4-3-5-11(14)17/h3-8H,2H2,1H3,(H2,18,19,20,21,22)
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250n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))
BDBM50434821
PNG
(CHEMBL2387224)
Show SMILES Clc1cccc(Cl)c1C(=O)Nc1ccnc(NC(=O)C2CC2)c1
Show InChI InChI=1S/C16H13Cl2N3O2/c17-11-2-1-3-12(18)14(11)16(23)20-10-6-7-19-13(8-10)21-15(22)9-4-5-9/h1-3,6-9H,4-5H2,(H2,19,20,21,22,23)
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253n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK3 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50439015
PNG
(CHEMBL2420821)
Show SMILES CC(=O)Nc1cc(NC(=O)c2c(Cl)cccc2Cl)ccn1
Show InChI InChI=1S/C14H11Cl2N3O2/c1-8(20)18-12-7-9(5-6-17-12)19-14(21)13-10(15)3-2-4-11(13)16/h2-7H,1H3,(H2,17,18,19,20,21)
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310n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK1


(Homo sapiens (Human))
BDBM50439014
PNG
(CHEMBL2420829)
Show SMILES CCn1cc(Nc2cc(NC(=O)c3c(Cl)cccc3Cl)ccn2)cn1
Show InChI InChI=1S/C17H15Cl2N5O/c1-2-24-10-12(9-21-24)22-15-8-11(6-7-20-15)23-17(25)16-13(18)4-3-5-14(16)19/h3-10H,2H2,1H3,(H2,20,22,23,25)
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360n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK1 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50439013
PNG
(CHEMBL2420835)
Show SMILES Clc1cccc(Cl)c1C(=O)Nc1ccnc(NC(=O)CC2CC2)c1
Show InChI InChI=1S/C17H15Cl2N3O2/c18-12-2-1-3-13(19)16(12)17(24)21-11-6-7-20-14(9-11)22-15(23)8-10-4-5-10/h1-3,6-7,9-10H,4-5,8H2,(H2,20,21,22,23,24)
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380n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK1


(Homo sapiens (Human))
BDBM50439012
PNG
(CHEMBL2420812)
Show SMILES CCNC(=O)Nc1cc(NC(=O)c2c(Cl)cccc2Cl)ccn1
Show InChI InChI=1S/C15H14Cl2N4O2/c1-2-18-15(23)21-12-8-9(6-7-19-12)20-14(22)13-10(16)4-3-5-11(13)17/h3-8H,2H2,1H3,(H3,18,19,20,21,22,23)
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430n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK1 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK1


(Homo sapiens (Human))
BDBM50439011
PNG
(CHEMBL2420826)
Show SMILES Clc1cccc(Cl)c1C(=O)Nc1ccnc(Nc2cnccn2)c1
Show InChI InChI=1S/C16H11Cl2N5O/c17-11-2-1-3-12(18)15(11)16(24)22-10-4-5-20-13(8-10)23-14-9-19-6-7-21-14/h1-9H,(H2,20,21,22,23,24)
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490n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK1 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50439010
PNG
(CHEMBL2420836)
Show SMILES Clc1cccc(Cl)c1C(=O)Nc1ccnc(NC(=O)C2CCC2)c1
Show InChI InChI=1S/C17H15Cl2N3O2/c18-12-5-2-6-13(19)15(12)17(24)21-11-7-8-20-14(9-11)22-16(23)10-3-1-4-10/h2,5-10H,1,3-4H2,(H2,20,21,22,23,24)
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510n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50439009
PNG
(CHEMBL2420813)
Show SMILES COC(=O)Nc1cc(NC(=O)c2c(Cl)cccc2Cl)ccn1
Show InChI InChI=1S/C14H11Cl2N3O3/c1-22-14(21)19-11-7-8(5-6-17-11)18-13(20)12-9(15)3-2-4-10(12)16/h2-7H,1H3,(H2,17,18,19,20,21)
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610n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50439008
PNG
(CHEMBL2420823)
Show SMILES Clc1cccc(Cl)c1C(=O)Nc1ccnc(Nc2ccccc2)c1
Show InChI InChI=1S/C18H13Cl2N3O/c19-14-7-4-8-15(20)17(14)18(24)23-13-9-10-21-16(11-13)22-12-5-2-1-3-6-12/h1-11H,(H2,21,22,23,24)
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860n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK1


(Homo sapiens (Human))
BDBM50439007
PNG
(CHEMBL2420824)
Show SMILES Clc1cccc(Cl)c1C(=O)Nc1ccnc(Nc2ccccn2)c1
Show InChI InChI=1S/C17H12Cl2N4O/c18-12-4-3-5-13(19)16(12)17(24)22-11-7-9-21-15(10-11)23-14-6-1-2-8-20-14/h1-10H,(H2,20,21,22,23,24)
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1.00E+3n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK1 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK1


(Homo sapiens (Human))
BDBM50439006
PNG
(CHEMBL2420828)
Show SMILES Clc1cccc(Cl)c1C(=O)Nc1ccnc(Nc2cccnn2)c1
Show InChI InChI=1S/C16H11Cl2N5O/c17-11-3-1-4-12(18)15(11)16(24)21-10-6-8-19-14(9-10)22-13-5-2-7-20-23-13/h1-9H,(H2,19,21,22,23,24)
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1.00E+3n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK1 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK1


(Homo sapiens (Human))
BDBM50439005
PNG
(CHEMBL2420830)
Show SMILES Clc1cccc(Cl)c1C(=O)Nc1ccnc2[nH]ccc12
Show InChI InChI=1S/C14H9Cl2N3O/c15-9-2-1-3-10(16)12(9)14(20)19-11-5-7-18-13-8(11)4-6-17-13/h1-7H,(H2,17,18,19,20)
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1.10E+3n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK1 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50439025
PNG
(CHEMBL1327969)
Show SMILES Clc1cccc(Cl)c1C(=O)Nc1ccncc1
Show InChI InChI=1S/C12H8Cl2N2O/c13-9-2-1-3-10(14)11(9)12(17)16-8-4-6-15-7-5-8/h1-7H,(H,15,16,17)
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1.20E+3n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50439034
PNG
(CHEMBL2420811)
Show SMILES Clc1cccc(Cl)c1C(=O)Nc1ccnc(NC(=O)C2CCCO2)c1
Show InChI InChI=1S/C17H15Cl2N3O3/c18-11-3-1-4-12(19)15(11)17(24)21-10-6-7-20-14(9-10)22-16(23)13-5-2-8-25-13/h1,3-4,6-7,9,13H,2,5,8H2,(H2,20,21,22,23,24)
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1.30E+3n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50439032
PNG
(CHEMBL2420839)
Show SMILES OCC(=O)Nc1cc(NC(=O)c2c(Cl)cccc2Cl)ccn1
Show InChI InChI=1S/C14H11Cl2N3O3/c15-9-2-1-3-10(16)13(9)14(22)18-8-4-5-17-11(6-8)19-12(21)7-20/h1-6,20H,7H2,(H2,17,18,19,21,22)
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1.40E+3n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50439033
PNG
(CHEMBL2420817)
Show SMILES Clc1cccc(Cl)c1-c1nc(c[nH]1)-c1ccncc1
Show InChI InChI=1S/C14H9Cl2N3/c15-10-2-1-3-11(16)13(10)14-18-8-12(19-14)9-4-6-17-7-5-9/h1-8H,(H,18,19)
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1.40E+3n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK1


(Homo sapiens (Human))
BDBM50439010
PNG
(CHEMBL2420836)
Show SMILES Clc1cccc(Cl)c1C(=O)Nc1ccnc(NC(=O)C2CCC2)c1
Show InChI InChI=1S/C17H15Cl2N3O2/c18-12-5-2-6-13(19)15(12)17(24)21-11-7-8-20-14(9-11)22-16(23)10-3-1-4-10/h2,5-10H,1,3-4H2,(H2,20,21,22,23,24)
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1.50E+3n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK1 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK1


(Homo sapiens (Human))
BDBM50439028
PNG
(CHEMBL2420844)
Show SMILES Fc1cccc(Cl)c1C(=O)Nc1ccncc1
Show InChI InChI=1S/C12H8ClFN2O/c13-9-2-1-3-10(14)11(9)12(17)16-8-4-6-15-7-5-8/h1-7H,(H,15,16,17)
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1.70E+3n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK1 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK1


(Homo sapiens (Human))
BDBM50439031
PNG
(CHEMBL2420846)
Show SMILES Nc1cccc(Cl)c1C(=O)Nc1ccncc1
Show InChI InChI=1S/C12H10ClN3O/c13-9-2-1-3-10(14)11(9)12(17)16-8-4-6-15-7-5-8/h1-7H,14H2,(H,15,16,17)
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1.70E+3n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK1 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50439030
PNG
(CHEMBL1702157)
Show SMILES Clc1ccccc1C(=O)Nc1ccncc1
Show InChI InChI=1S/C12H9ClN2O/c13-11-4-2-1-3-10(11)12(16)15-9-5-7-14-8-6-9/h1-8H,(H,14,15,16)
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1.70E+3n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50439026
PNG
(CHEMBL2420851)
Show SMILES Clc1ccc(Cl)c(c1)C(=O)Nc1ccncc1
Show InChI InChI=1S/C12H8Cl2N2O/c13-8-1-2-11(14)10(7-8)12(17)16-9-3-5-15-6-4-9/h1-7H,(H,15,16,17)
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1.70E+3n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50439029
PNG
(CHEMBL2420852)
Show SMILES FC(F)(F)c1ccc(Cl)c(c1)C(=O)Nc1ccncc1
Show InChI InChI=1S/C13H8ClF3N2O/c14-11-2-1-8(13(15,16)17)7-10(11)12(20)19-9-3-5-18-6-4-9/h1-7H,(H,18,19,20)
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1.80E+3n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50439028
PNG
(CHEMBL2420844)
Show SMILES Fc1cccc(Cl)c1C(=O)Nc1ccncc1
Show InChI InChI=1S/C12H8ClFN2O/c13-9-2-1-3-10(14)11(9)12(17)16-8-4-6-15-7-5-8/h1-7H,(H,15,16,17)
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2.00E+3n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50439027
PNG
(CHEMBL2420818)
Show SMILES Clc1cccc(Cl)c1-c1nnc([nH]1)-c1ccncc1
Show InChI InChI=1S/C13H8Cl2N4/c14-9-2-1-3-10(15)11(9)13-17-12(18-19-13)8-4-6-16-7-5-8/h1-7H,(H,17,18,19)
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2.00E+3n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK1


(Homo sapiens (Human))
BDBM50439029
PNG
(CHEMBL2420852)
Show SMILES FC(F)(F)c1ccc(Cl)c(c1)C(=O)Nc1ccncc1
Show InChI InChI=1S/C13H8ClF3N2O/c14-11-2-1-8(13(15,16)17)7-10(11)12(20)19-9-3-5-18-6-4-9/h1-7H,(H,18,19,20)
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2.00E+3n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK1 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK1


(Homo sapiens (Human))
BDBM50439026
PNG
(CHEMBL2420851)
Show SMILES Clc1ccc(Cl)c(c1)C(=O)Nc1ccncc1
Show InChI InChI=1S/C12H8Cl2N2O/c13-8-1-2-11(14)10(7-8)12(17)16-9-3-5-15-6-4-9/h1-7H,(H,15,16,17)
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2.10E+3n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK1 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK1


(Homo sapiens (Human))
BDBM50439025
PNG
(CHEMBL1327969)
Show SMILES Clc1cccc(Cl)c1C(=O)Nc1ccncc1
Show InChI InChI=1S/C12H8Cl2N2O/c13-9-2-1-3-10(14)11(9)12(17)16-8-4-6-15-7-5-8/h1-7H,(H,15,16,17)
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2.20E+3n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK1 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50439023
PNG
(CHEMBL2420840)
Show SMILES NCC(=O)Nc1cc(NC(=O)c2c(Cl)cccc2Cl)ccn1
Show InChI InChI=1S/C14H12Cl2N4O2/c15-9-2-1-3-10(16)13(9)14(22)19-8-4-5-18-11(6-8)20-12(21)7-17/h1-6H,7,17H2,(H2,18,19,20,21,22)
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2.40E+3n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK1


(Homo sapiens (Human))
BDBM50439016
PNG
(CHEMBL2420832)
Show SMILES CCC(=O)Nc1cc(NC(=O)c2c(Cl)cccc2Cl)ccn1
Show InChI InChI=1S/C15H13Cl2N3O2/c1-2-13(21)20-12-8-9(6-7-18-12)19-15(22)14-10(16)4-3-5-11(14)17/h3-8H,2H2,1H3,(H2,18,19,20,21,22)
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2.40E+3n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK1 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50439024
PNG
(CHEMBL2420837)
Show SMILES Clc1cccc(Cl)c1C(=O)Nc1ccnc(NC(=O)C2CCCC2)c1
Show InChI InChI=1S/C18H17Cl2N3O2/c19-13-6-3-7-14(20)16(13)18(25)22-12-8-9-21-15(10-12)23-17(24)11-4-1-2-5-11/h3,6-11H,1-2,4-5H2,(H2,21,22,23,24,25)
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2.40E+3n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50439022
PNG
(CHEMBL2420825)
Show SMILES Clc1cccc(Cl)c1C(=O)Nc1ccnc(Nc2ncccn2)c1
Show InChI InChI=1S/C16H11Cl2N5O/c17-11-3-1-4-12(18)14(11)15(24)22-10-5-8-19-13(9-10)23-16-20-6-2-7-21-16/h1-9H,(H2,19,20,21,22,23,24)
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2.50E+3n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK1


(Homo sapiens (Human))
BDBM50439009
PNG
(CHEMBL2420813)
Show SMILES COC(=O)Nc1cc(NC(=O)c2c(Cl)cccc2Cl)ccn1
Show InChI InChI=1S/C14H11Cl2N3O3/c1-22-14(21)19-11-7-8(5-6-17-11)18-13(20)12-9(15)3-2-4-10(12)16/h2-7H,1H3,(H2,17,18,19,20,21)
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2.60E+3n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK1 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50439021
PNG
(CHEMBL2420838)
Show SMILES Clc1cccc(Cl)c1C(=O)Nc1ccnc(NC(=O)c2ccccc2)c1
Show InChI InChI=1S/C19H13Cl2N3O2/c20-14-7-4-8-15(21)17(14)19(26)23-13-9-10-22-16(11-13)24-18(25)12-5-2-1-3-6-12/h1-11H,(H2,22,23,24,25,26)
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2.70E+3n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM39263
PNG
(2,6-bis(fluoranyl)-N-pyridin-4-yl-benzamide | 2,6-...)
Show SMILES Fc1cccc(F)c1C(=O)Nc1ccncc1
Show InChI InChI=1S/C12H8F2N2O/c13-9-2-1-3-10(14)11(9)12(17)16-8-4-6-15-7-5-8/h1-7H,(H,15,16,17)
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2.80E+3n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50439042
PNG
(CHEMBL2420819)
Show SMILES Nc1cc(NC(=O)c2c(Cl)cccc2Cl)ccn1
Show InChI InChI=1S/C12H9Cl2N3O/c13-8-2-1-3-9(14)11(8)12(18)17-7-4-5-16-10(15)6-7/h1-6H,(H3,15,16,17,18)
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2.90E+3n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK2 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK1


(Homo sapiens (Human))
BDBM50439015
PNG
(CHEMBL2420821)
Show SMILES CC(=O)Nc1cc(NC(=O)c2c(Cl)cccc2Cl)ccn1
Show InChI InChI=1S/C14H11Cl2N3O2/c1-8(20)18-12-7-9(5-6-17-12)19-14(21)13-10(15)3-2-4-11(13)16/h2-7H,1H3,(H2,17,18,19,20,21)
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2.90E+3n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK1 (unknown origin)


Eur J Med Chem 67: 175-87 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.070
BindingDB Entry DOI: 10.7270/Q2416ZGB
More data for this
Ligand-Target Pair
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