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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase SYK' and Ligand = 'BDBM212267'   
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))
BDBM212267
PNG
(US9290490, Example 1 (faster eluting isomer))
Show SMILES Cc1cc(Nc2nccc(n2)C(F)(F)F)cc(c1)-c1cnc(s1)[C@@](C)(O)[C@H]1CC[C@@H](CC1)C(O)=O |wU:23.27,26.28,wD:29.35,23.25,(-.18,14.64,;1.16,13.87,;2.49,14.64,;3.82,13.87,;5.16,14.64,;5.16,16.18,;3.82,16.95,;3.82,18.49,;5.16,19.26,;6.49,18.49,;6.49,16.95,;7.82,19.26,;9.16,20.03,;8.59,17.93,;7.05,20.6,;3.82,12.33,;2.49,11.56,;1.16,12.33,;2.49,10.02,;1.24,9.12,;1.72,7.65,;3.26,7.65,;3.73,9.12,;4.16,6.41,;5.41,7.31,;2.92,5.5,;5.07,5.16,;6.6,5.32,;7.51,4.08,;6.88,2.67,;5.35,2.51,;4.44,3.75,;7.78,1.42,;9.32,1.58,;7.16,.02,)|
Show InChI InChI=1S/C24H25F3N4O3S/c1-13-9-15(11-17(10-13)30-22-28-8-7-19(31-22)24(25,26)27)18-12-29-21(35-18)23(2,34)16-5-3-14(4-6-16)20(32)33/h7-12,14,16,34H,3-6H2,1-2H3,(H,32,33)(H,28,30,31)/t14-,16-,23-/m0/s1
PDB
MMDB

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PC cid
PC sid
UniChem
US Patent
n/an/a<0.5n/an/an/an/a7.525



Merck Sharp & Dohme Corp.

US Patent


Assay Description
A recombinant GST-hSyk fusion protein was used to measure potency of compounds to inhibit human Syk activity. The recombinant human GST-Syk (Carna Bi...


US Patent US9290490 (2016)


BindingDB Entry DOI: 10.7270/Q2Z0370B
More data for this
Ligand-Target Pair