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SMILES: CCNC1CCN(C1)c1ccc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)NC(C)C)n2)c(OC)c1

InChI Key: InChIKey=LHMIGAGDYPHXSW-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50300388   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Tyrosine-protein kinase ZAP-70


(Homo sapiens (Human))		BDBM50300388
PNG
(2-(5-chloro-2-(4-(3-(ethylamino)pyrrolidin-1-yl)-2...)
Show SMILES CCNC1CCN(C1)c1ccc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)NC(C)C)n2)c(OC)c1
Show InChI InChI=1S/C26H34ClN7O3S/c1-5-28-18-12-13-34(16-18)19-10-11-21(23(14-19)37-4)31-26-29-15-20(27)25(32-26)30-22-8-6-7-9-24(22)38(35,36)33-17(2)3/h6-11,14-15,17-18,28,33H,5,12-13,16H2,1-4H3,(H2,29,30,31,32)
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GVK Biosciences Pvt. Ltd.

Curated by ChEMBL


Assay Description
Inhibition of human GST-fused ZAP-70 expressed in Sf9 cells

Eur J Med Chem 44: 4793-800 (2009)


Article DOI: 10.1016/j.ejmech.2009.07.018
BindingDB Entry DOI: 10.7270/Q25X290Z
More data for this
Ligand-Target Pair