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SMILES: CC1CN(CC(C)O1)C1CCN(CC1)C(=O)c1ccc(Nc2nc3c(cccn3n2)C2=CCN(CC2)C(=O)CCC(F)(F)F)cc1

InChI Key: InChIKey=UYOFPZQMLBOVKX-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 366863   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM366863
PNG
(1-[4-[2-[4-[4-(2,6- dimethylmorpholin-4- yl)piperi...)
Show SMILES CC1CN(CC(C)O1)C1CCN(CC1)C(=O)c1ccc(Nc2nc3c(cccn3n2)C2=CCN(CC2)C(=O)CCC(F)(F)F)cc1 |t:34|
Show InChI InChI=1S/C33H40F3N7O3/c1-22-20-42(21-23(2)46-22)27-12-18-41(19-13-27)31(45)25-5-7-26(8-6-25)37-32-38-30-28(4-3-15-43(30)39-32)24-10-16-40(17-11-24)29(44)9-14-33(34,35)36/h3-8,10,15,22-23,27H,9,11-14,16-21H2,1-2H3,(H,37,39)
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UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
0.270n/an/an/an/an/an/an/an/a



Duquesne University



Assay Description
The activity of the isolated recombinant JAK1 and JAK2 kinase domain was measured by monitoring phosphorylation of a peptide derived from JAK3 (Val-A...


J Med Chem 51: 68-76 (2008)


BindingDB Entry DOI: 10.7270/Q2CC130F
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK1


(Homo sapiens (Human))
BDBM366863
PNG
(1-[4-[2-[4-[4-(2,6- dimethylmorpholin-4- yl)piperi...)
Show SMILES CC1CN(CC(C)O1)C1CCN(CC1)C(=O)c1ccc(Nc2nc3c(cccn3n2)C2=CCN(CC2)C(=O)CCC(F)(F)F)cc1 |t:34|
Show InChI InChI=1S/C33H40F3N7O3/c1-22-20-42(21-23(2)46-22)27-12-18-41(19-13-27)31(45)25-5-7-26(8-6-25)37-32-38-30-28(4-3-15-43(30)39-32)24-10-16-40(17-11-24)29(44)9-14-33(34,35)36/h3-8,10,15,22-23,27H,9,11-14,16-21H2,1-2H3,(H,37,39)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
0.710n/an/an/an/an/an/an/an/a



Duquesne University



Assay Description
The activity of the isolated recombinant JAK1 and JAK2 kinase domain was measured by monitoring phosphorylation of a peptide derived from JAK3 (Val-A...


J Med Chem 51: 68-76 (2008)


BindingDB Entry DOI: 10.7270/Q2CC130F
More data for this
Ligand-Target Pair