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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 = 'BDBM50107899'   
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))		BDBM50107899
PNG
(2-[4-(4-{2-[(5-Carboxy-pentyl)-(3-cyclohexyl-propy...)
Show SMILES OC(=O)CCCCCN(CCCC1CCCCC1)S(=O)(=O)\C=C\c1ccc(NC(=O)[C@H]2CC[C@@H](CC2)C(C(O)=O)C(O)=O)cc1 |wU:30.30,wD:33.37,(-.42,-5.98,;.35,-4.65,;-.42,-3.32,;1.89,-4.65,;2.66,-5.98,;4.2,-5.98,;4.97,-7.33,;6.51,-7.33,;7.28,-8.66,;6.51,-9.99,;4.97,-9.99,;4.2,-11.33,;2.66,-11.33,;1.87,-12.65,;.33,-12.65,;-.44,-11.33,;.35,-9.99,;1.87,-9.99,;8.82,-8.66,;8.8,-10.2,;8.8,-7.12,;10.36,-8.64,;11.11,-7.29,;12.65,-7.28,;13.39,-5.94,;14.95,-5.91,;15.73,-7.25,;17.27,-7.23,;18.04,-5.88,;17.24,-4.57,;19.58,-5.88,;20.32,-4.53,;21.86,-4.53,;22.65,-5.85,;21.89,-7.2,;20.35,-7.2,;24.19,-5.85,;24.96,-4.5,;26.5,-4.5,;24.17,-3.19,;24.97,-7.17,;26.51,-7.17,;24.2,-8.51,;14.98,-8.58,;13.42,-8.6,)|
Show InChI InChI=1S/C33H48N2O9S/c36-29(37)11-5-2-6-21-35(22-7-10-24-8-3-1-4-9-24)45(43,44)23-20-25-12-18-28(19-13-25)34-31(38)27-16-14-26(15-17-27)30(32(39)40)33(41)42/h12-13,18-20,23-24,26-27,30H,1-11,14-17,21-22H2,(H,34,38)(H,36,37)(H,39,40)(H,41,42)/b23-20+/t26-,27-
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MMDB

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PubMed
n/an/a 3.80E+4n/an/an/an/an/an/a



Waseda University

Curated by ChEMBL


Assay Description
Inhibitory activity against Syk C-terminal SH2.

J Med Chem 44: 4737-40 (2001)


BindingDB Entry DOI: 10.7270/Q2TX3DPF
More data for this
Ligand-Target Pair