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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase JAK2' and Ligand = 'BDBM127795'   
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))
BDBM127795
PNG
(US10251889, Example 168 | US10758542, Example 168 ...)
Show SMILES CC(C)(CO)CNC(=O)c1cnn2ccc(nc12)N1CCCC1c1cc(F)ccc1F
Show InChI InChI=1S/C22H25F2N5O2/c1-22(2,13-30)12-25-21(31)16-11-26-29-9-7-19(27-20(16)29)28-8-3-4-18(28)15-10-14(23)5-6-17(15)24/h5-7,9-11,18,30H,3-4,8,12-13H2,1-2H3,(H,25,31)
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PC cid
PC sid
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Similars

US Patent
n/an/a 1.20n/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))
BDBM127795
PNG
(US10251889, Example 168 | US10758542, Example 168 ...)
Show SMILES CC(C)(CO)CNC(=O)c1cnn2ccc(nc12)N1CCCC1c1cc(F)ccc1F
Show InChI InChI=1S/C22H25F2N5O2/c1-22(2,13-30)12-25-21(31)16-11-26-29-9-7-19(27-20(16)29)28-8-3-4-18(28)15-10-14(23)5-6-17(15)24/h5-7,9-11,18,30H,3-4,8,12-13H2,1-2H3,(H,25,31)
PDB

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KEGG

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antibodypedia
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PC cid
PC sid
UniChem

Similars

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 US8791123 (2014)


BindingDB Entry DOI: 10.7270/Q2Q23XX7
More data for this
Ligand-Target Pair