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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase SYK' and Ligand = 'BDBM50123576'   
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))
BDBM50123576
PNG
(CHEMBL3622210)
Show SMILES [H][C@@]1(CNC(=O)C1)[C@@H](C)Oc1cc(cc2nscc12)-c1cnn(c1)C(F)F |r|
Show InChI InChI=1/C17H16F2N4O2S/c1-9(11-4-16(24)20-5-11)25-15-3-10(2-14-13(15)8-26-22-14)12-6-21-23(7-12)17(18)19/h2-3,6-9,11,17H,4-5H2,1H3,(H,20,24)/t9-,11-/s2
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n/an/a 57n/an/an/an/an/an/a



Novartis Institutes for Biomedical Research

Curated by ChEMBL


Assay Description
Inhibition of Syk (unknown origin) using 5-Fluo-Ahx-GAPDYENLQELNKK-Amide as substrate after 60 mins by microfluidic mobility shift assay


Bioorg Med Chem Lett 25: 4642-7 (2015)


BindingDB Entry DOI: 10.7270/Q2XD13HG
More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM50123576
PNG
(CHEMBL3622210)
Show SMILES [H][C@@]1(CNC(=O)C1)[C@@H](C)Oc1cc(cc2nscc12)-c1cnn(c1)C(F)F |r|
Show InChI InChI=1/C17H16F2N4O2S/c1-9(11-4-16(24)20-5-11)25-15-3-10(2-14-13(15)8-26-22-14)12-6-21-23(7-12)17(18)19/h2-3,6-9,11,17H,4-5H2,1H3,(H,20,24)/t9-,11-/s2
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n/an/a 340n/an/an/an/an/an/a



Novartis Institutes for Biomedical Research

Curated by ChEMBL


Assay Description
Inhibition of Syk in anti-igM stimulated human Ramos B cells assessed as phospho-BLNK level preincubated for 30 mins followed by anti-IgM stimulation...


Bioorg Med Chem Lett 25: 4642-7 (2015)


BindingDB Entry DOI: 10.7270/Q2XD13HG
More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM50123576
PNG
(CHEMBL3622210)
Show SMILES [H][C@@]1(CNC(=O)C1)[C@@H](C)Oc1cc(cc2nscc12)-c1cnn(c1)C(F)F |r|
Show InChI InChI=1/C17H16F2N4O2S/c1-9(11-4-16(24)20-5-11)25-15-3-10(2-14-13(15)8-26-22-14)12-6-21-23(7-12)17(18)19/h2-3,6-9,11,17H,4-5H2,1H3,(H,20,24)/t9-,11-/s2
PDB
MMDB

NCI pathway
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KEGG

UniProtKB/SwissProt

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PC cid
PC sid
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n/an/a 1.02E+3n/an/an/an/an/an/a



Novartis Institutes for Biomedical Research

Curated by ChEMBL


Assay Description
Inhibition of Syk in anti-CD32 stimulated CD14+ human monocytes in presence of 90% human blood assessed as phospho-SLP76 level preincubated for 30 mi...


Bioorg Med Chem Lett 25: 4642-7 (2015)


BindingDB Entry DOI: 10.7270/Q2XD13HG
More data for this
Ligand-Target Pair