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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase JAK1' and Ligand = 'BDBM270855'   
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 JAK1


(Homo sapiens (Human))
BDBM270855
PNG
(US10059709, 1)
Show SMILES CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)N(C)c1ncnc2[nH]c(C)nc12 |r,wU:9.12,wD:6.5,(5.33,2.8,;4,2.03,;2.67,2.8,;3.44,4.13,;1.9,1.46,;1.33,3.57,;,2.8,;-1.33,3.57,;-2.67,2.8,;-2.67,1.26,;-1.33,.49,;,1.26,;-4,.49,;-5.33,1.26,;-4,-1.05,;-5.33,-1.82,;-5.33,-3.36,;-4,-4.13,;-2.67,-3.36,;-1.2,-3.84,;-.3,-2.59,;1.24,-2.59,;-1.2,-1.35,;-2.67,-1.82,)|
Show InChI InChI=1S/C15H24N6O2S/c1-10-19-13-14(20-10)17-9-18-15(13)21(3)12-6-4-11(5-7-12)8-24(22,23)16-2/h9,11-12,16H,4-8H2,1-3H3,(H,17,18,19,20)/t11-,12-
PDB

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US Patent
n/an/a 838n/an/an/an/an/an/a



Elanco Tiergesundheit AG

US Patent


Assay Description
All four kinases of the JAK/TYK-kinase family were used as purified recombinant GST-fusion proteins, containing the active kinase domains. GST-JAK1(8...


US Patent US10059709 (2018)


BindingDB Entry DOI: 10.7270/Q25X2BZX
More data for this
Ligand-Target Pair