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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 = 'BDBM232619'   
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))
BDBM232619
PNG
(US9346815, 165 | US9604984, Example 165)
Show SMILES NC(=O)CCN1CCC(CC1)n1cc(NC(=O)c2c(N)nn3cccnc23)c(n1)-c1cc(Cl)ccc1OC(F)F
Show InChI InChI=1S/C25H26ClF2N9O3/c26-14-2-3-18(40-25(27)28)16(12-14)21-17(32-24(39)20-22(30)34-36-8-1-7-31-23(20)36)13-37(33-21)15-4-9-35(10-5-15)11-6-19(29)38/h1-3,7-8,12-13,15,25H,4-6,9-11H2,(H2,29,38)(H2,30,34)(H,32,39)
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PC cid
PC sid
UniChem
US Patent
0.150n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent




US Patent US9604984 (2017)


BindingDB Entry DOI: 10.7270/Q26D5W25
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM232619
PNG
(US9346815, 165 | US9604984, Example 165)
Show SMILES NC(=O)CCN1CCC(CC1)n1cc(NC(=O)c2c(N)nn3cccnc23)c(n1)-c1cc(Cl)ccc1OC(F)F
Show InChI InChI=1S/C25H26ClF2N9O3/c26-14-2-3-18(40-25(27)28)16(12-14)21-17(32-24(39)20-22(30)34-36-8-1-7-31-23(20)36)13-37(33-21)15-4-9-35(10-5-15)11-6-19(29)38/h1-3,7-8,12-13,15,25H,4-6,9-11H2,(H2,29,38)(H2,30,34)(H,32,39)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
0.150 -55.5n/an/an/an/an/a7.222



Genentech, Inc.

US Patent


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...


US Patent US9346815 (2016)


BindingDB Entry DOI: 10.7270/Q2NS0SRT
More data for this
Ligand-Target Pair