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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase JAK2' and Ligand = 'BDBM127703'   
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))
BDBM127703
PNG
(US10251889, Example 76 | US10758542, Example 76 | ...)
Show SMILES NC(=O)c1cnn2ccc(nc12)N1CCC[C@@H]1c1cc(F)cc(OCCN2CCOCC2)c1 |r|
Show InChI InChI=1S/C23H27FN6O3/c24-17-12-16(13-18(14-17)33-11-8-28-6-9-32-10-7-28)20-2-1-4-29(20)21-3-5-30-23(27-21)19(15-26-30)22(25)31/h3,5,12-15,20H,1-2,4,6-11H2,(H2,25,31)/t20-/m1/s1
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US Patent
n/an/a 90n/an/an/an/an/an/a



St. Jude Research Hospital



Assay Description
Compounds of Formula I were screened for their ability to inhibit Jak2 using the general enzyme inhibition assay method, in which the assay mixture c...


J Med Chem 50: 1876-85 (2007)


BindingDB Entry DOI: 10.7270/Q2R49T22
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM127703
PNG
(US10251889, Example 76 | US10758542, Example 76 | ...)
Show SMILES NC(=O)c1cnn2ccc(nc12)N1CCC[C@@H]1c1cc(F)cc(OCCN2CCOCC2)c1 |r|
Show InChI InChI=1S/C23H27FN6O3/c24-17-12-16(13-18(14-17)33-11-8-28-6-9-32-10-7-28)20-2-1-4-29(20)21-3-5-30-23(27-21)19(15-26-30)22(25)31/h3,5,12-15,20H,1-2,4,6-11H2,(H2,25,31)/t20-/m1/s1
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n/an/a>1.00E+3n/an/an/an/an/an/a



Array Biopharma, Inc.

US Patent


Assay Description
Compounds of Formula I were screened for their ability to inhibit Jak2 using the general enzyme inhibition assay method, in which the assay mixture c...


US Patent US8791123 (2014)


BindingDB Entry DOI: 10.7270/Q2Q23XX7
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM127703
PNG
(US10251889, Example 76 | US10758542, Example 76 | ...)
Show SMILES NC(=O)c1cnn2ccc(nc12)N1CCC[C@@H]1c1cc(F)cc(OCCN2CCOCC2)c1 |r|
Show InChI InChI=1S/C23H27FN6O3/c24-17-12-16(13-18(14-17)33-11-8-28-6-9-32-10-7-28)20-2-1-4-29(20)21-3-5-30-23(27-21)19(15-26-30)22(25)31/h3,5,12-15,20H,1-2,4,6-11H2,(H2,25,31)/t20-/m1/s1
PDB

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US Patent
n/an/a>1.00E+3n/an/an/an/an/an/a



Array BioPharma, Inc.

US Patent


Assay Description
Compounds of Formula I were screened for their ability to inhibit Jak2 using the general enzyme inhibition assay method, in which the assay mixture c...


US Patent US9782415 (2017)


BindingDB Entry DOI: 10.7270/Q2P84F0G
More data for this
Ligand-Target Pair