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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase JAK3' and Ligand = 'BDBM412685'   
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 JAK3


(Homo sapiens (Human))
BDBM412685
PNG
(US10399979, Compound 17i)
Show SMILES COC(=O)[C@@H](C(C)C)n1c2c3cc[nH]c3ncc2c2cc(OC)c(OC)cc2c1=O |r|
PDB

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KEGG

UniProtKB/SwissProt

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US Patent
n/an/a 28.9n/an/an/an/an/an/a



Purdue Research Foundation

US Patent


Assay Description
Reagents used in JAK inhibition assay: Base Reaction buffer; 20 mM Hepes (pH 7.5), 10 mM MgCl2, 1 mM EGTA, 0.02% Brij35, 0.02 mg/ml BSA, 0.1 mM Na3VO...


US Patent US10399979 (2019)


BindingDB Entry DOI: 10.7270/Q29G5Q52
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))
BDBM412685
PNG
(US10399979, Compound 17i)
Show SMILES COC(=O)[C@@H](C(C)C)n1c2c3cc[nH]c3ncc2c2cc(OC)c(OC)cc2c1=O |r|
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
UniChem
Article
PubMed
n/an/a 29n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of JAK3 (unknown origin) preincubated for 20 mins followed by [33P]-ATP addition measured after 2 hrs by filter-binding method


J Med Chem 61: 10440-10462 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00510
BindingDB Entry DOI: 10.7270/Q2BR8VVW
More data for this
Ligand-Target Pair