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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase Lck' and Ligand = 'BDBM50112980'   
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 Lck


(Homo sapiens (Human))		BDBM50112980
PNG
((1R,3R)-3-({(1S,9S)-9-[(S)-2-Acetylamino-3-(4-phos...)
Show SMILES CC(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@H]1CCC(=O)N2CCC[C@H](N2C1=O)C(=O)N[C@@H]1C[C@@H](C(O)=O)c2ccccc12
Show InChI InChI=1S/C31H36N5O11P/c1-17(37)32-25(15-18-8-10-19(11-9-18)47-48(44,45)46)28(39)33-23-12-13-27(38)35-14-4-7-26(36(35)30(23)41)29(40)34-24-16-22(31(42)43)20-5-2-3-6-21(20)24/h2-3,5-6,8-11,22-26H,4,7,12-16H2,1H3,(H,32,37)(H,33,39)(H,34,40)(H,42,43)(H2,44,45,46)/t22-,23+,24-,25+,26+/m1/s1
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n/an/a 100n/an/an/an/an/an/a



Roche Products Limited

Curated by ChEMBL


Assay Description
Inhibitory activity towards p56 Lck tyrosine kinase SH2 domain using scintillation proximity assay (SPA)

Bioorg Med Chem Lett 12: 1365-9 (2002)


BindingDB Entry DOI: 10.7270/Q20002MH
More data for this
Ligand-Target Pair