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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Apoptosis regulator Bcl-2' and Ligand = 'BDBM50261502'   
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
Apoptosis regulator Bcl-2


(Homo sapiens (Human))		BDBM50261502
PNG
(CHEMBL4088301)
Show SMILES COc1ccc2n(c(C)c(CC(=O)N[C@@H](Cc3ccccc3)C(=O)NS(=O)(=O)c3ccc(Cl)cc3)c2c1)-c1ccc(cc1)-c1ccccc1 |r|
Show InChI InChI=1S/C39H34ClN3O5S/c1-26-34(35-24-32(48-2)19-22-37(35)43(26)31-17-13-29(14-18-31)28-11-7-4-8-12-28)25-38(44)41-36(23-27-9-5-3-6-10-27)39(45)42-49(46,47)33-20-15-30(40)16-21-33/h3-22,24,36H,23,25H2,1-2H3,(H,41,44)(H,42,45)/t36-/m0/s1
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Similars
Article
PubMed
 910n/an/an/an/an/an/an/an/a



Shandong University

Curated by ChEMBL


Assay Description
Inhibition of 5-FAM-Bid-BH3 peptide binding to Bcl2 (unknown origin) pre-incubated for 30 mins followed by further incubation with 5-FAM-Bid-BH3 pept...

Bioorg Med Chem 25: 5548-5556 (2017)


Article DOI: 10.1016/j.bmc.2017.08.024
BindingDB Entry DOI: 10.7270/Q2FX7CX8
More data for this
Ligand-Target Pair