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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase SYK' and Ligand = 'BDBM375945'   
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 SYK


(Homo sapiens (Human))
BDBM375945
PNG
(US10947243, Example 11 | US9914735, Example 11)
Show SMILES C[C@@H](Oc1nc(cc2nn(C)cc12)-c1cc2nn(C)cc2c(O[C@H](C)[C@@H]2CNC(=O)C2)n1)[C@H]1CNC(=O)C1 |r|
Show InChI InChI=1S/C26H30N8O4/c1-13(15-5-23(35)27-9-15)37-25-17-11-33(3)31-19(17)7-21(29-25)22-8-20-18(12-34(4)32-20)26(30-22)38-14(2)16-6-24(36)28-10-16/h7-8,11-16H,5-6,9-10H2,1-4H3,(H,27,35)(H,28,36)/t13-,14-,15-,16+/m1/s1
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 2n/an/an/an/an/an/a



University of Namur



Assay Description
Human GSK3beta (expressed and prified from SF21 cells) is obtained from the University Dundee/Scotland (Dr. James Hastie—Dept. of Biochemistry) ...


J Med Chem 51: 3077-80 (2008)


BindingDB Entry DOI: 10.7270/Q21G0PJ6
More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM375945
PNG
(US10947243, Example 11 | US9914735, Example 11)
Show SMILES C[C@@H](Oc1nc(cc2nn(C)cc12)-c1cc2nn(C)cc2c(O[C@H](C)[C@@H]2CNC(=O)C2)n1)[C@H]1CNC(=O)C1 |r|
Show InChI InChI=1S/C26H30N8O4/c1-13(15-5-23(35)27-9-15)37-25-17-11-33(3)31-19(17)7-21(29-25)22-8-20-18(12-34(4)32-20)26(30-22)38-14(2)16-6-24(36)28-10-16/h7-8,11-16H,5-6,9-10H2,1-4H3,(H,27,35)(H,28,36)/t13-,14-,15-,16+/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 935n/an/an/an/an/an/a



University of Namur



Assay Description
Recombinant human Syk (amino acids 342-635) was expressed as a fusion protein with an N-terminal GST tag, affinity-purified and deep-frozen at a conc...


J Med Chem 51: 3077-80 (2008)


BindingDB Entry DOI: 10.7270/Q21G0PJ6
More data for this
Ligand-Target Pair