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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'E3 ubiquitin-protein ligase XIAP' and Ligand = 'BDBM50314453'   
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
E3 ubiquitin-protein ligase XIAP


(Homo sapiens (Human))		BDBM50314453
PNG
((S)-N-((S)-3,3-dimethyl-1-oxo-1-((S)-2-(4-(quinoli...)
Show SMILES CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1c1nc(cs1)-c1ccnc2ccccc12)C(C)(C)C |r|
Show InChI InChI=1S/C26H33N5O2S/c1-16(27-5)23(32)30-22(26(2,3)4)25(33)31-14-8-11-21(31)24-29-20(15-34-24)18-12-13-28-19-10-7-6-9-17(18)19/h6-7,9-10,12-13,15-16,21-22,27H,8,11,14H2,1-5H3,(H,30,32)/t16-,21-,22+/m0/s1
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Similars
Article
PubMed
 1.30E+5n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Antagonist activity at XIAP BIR3 domain by fluorescence polarization assay ... On Thursday, November 10, 2011 9:19 AM from cohen.fred@gene.com: Unfor...

Bioorg Med Chem Lett 20: 2229-33 (2010)

Checked by Author
Article DOI: 10.1016/j.bmcl.2010.02.021
BindingDB Entry DOI: 10.7270/Q298875B
More data for this
Ligand-Target Pair