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1 similar compounds to monomer 50303050

Compile data set for download or QSAR
Wt: 357.3
BDBM50303049

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50303049   
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))
BDBM50303049
PNG
((S)-N2-(1-(5-fluoropyridin-2-yl)ethyl)-N6-(5-isopr...)
Show SMILES CC(C)Oc1cc(Nc2cncc(N[C@@H](C)c3ccc(F)cn3)n2)[nH]n1
Show InChI InChI=1/C17H20FN7O/c1-10(2)26-17-6-14(24-25-17)22-16-9-19-8-15(23-16)21-11(3)13-5-4-12(18)7-20-13/h4-11H,1-3H3,(H3,21,22,23,24,25)/t11-/s2
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PC cid
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Article
PubMed
n/an/a 421n/an/an/an/an/an/a



AstraZeneca R&D Boston

Curated by ChEMBL


Assay Description
Inhibition of JAK2 using 5 mM ATP as a substrate


Bioorg Med Chem Lett 19: 6524-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.10.054
BindingDB Entry DOI: 10.7270/Q2CV4HT4
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))
BDBM50303049
PNG
((S)-N2-(1-(5-fluoropyridin-2-yl)ethyl)-N6-(5-isopr...)
Show SMILES CC(C)Oc1cc(Nc2cncc(N[C@@H](C)c3ccc(F)cn3)n2)[nH]n1
Show InChI InChI=1/C17H20FN7O/c1-10(2)26-17-6-14(24-25-17)22-16-9-19-8-15(23-16)21-11(3)13-5-4-12(18)7-20-13/h4-11H,1-3H3,(H3,21,22,23,24,25)/t11-/s2
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Article
PubMed
n/an/a 1.52E+4n/an/an/an/an/an/a



AstraZeneca R&D Boston

Curated by ChEMBL


Assay Description
Inhibition of JAK3 using 5 mM ATP as a substrate


Bioorg Med Chem Lett 19: 6524-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.10.054
BindingDB Entry DOI: 10.7270/Q2CV4HT4
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50303049
PNG
((S)-N2-(1-(5-fluoropyridin-2-yl)ethyl)-N6-(5-isopr...)
Show SMILES CC(C)Oc1cc(Nc2cncc(N[C@@H](C)c3ccc(F)cn3)n2)[nH]n1
Show InChI InChI=1/C17H20FN7O/c1-10(2)26-17-6-14(24-25-17)22-16-9-19-8-15(23-16)21-11(3)13-5-4-12(18)7-20-13/h4-11H,1-3H3,(H3,21,22,23,24,25)/t11-/s2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 10n/an/an/an/an/an/a



AstraZeneca R&D Boston

Curated by ChEMBL


Assay Description
Inhibition of JAK2 using 2 mM ATP as a substrate


Bioorg Med Chem Lett 19: 6524-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.10.054
BindingDB Entry DOI: 10.7270/Q2CV4HT4
More data for this
Ligand-Target Pair