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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 = 'BDBM161631'   
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))		BDBM161631
PNG
(US9108983, Example 450)
Show SMILES Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1cc(nn1C)C#N)c1ccc(O)cc1
Show InChI InChI=1S/C39H38ClN7O4/c1-25-34(39(50)47(30-9-11-32(48)12-10-30)37-20-29(22-41)42-44(37)3)21-36(43(25)2)35-19-28(40)8-13-33(35)38(49)46-23-27-7-5-4-6-26(27)18-31(46)24-45-14-16-51-17-15-45/h4-13,19-21,31,48H,14-18,23-24H2,1-3H3/t31-/m0/s1
PDB

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PC cid
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Similars
US Patent
n/an/a 2.70n/an/an/an/a7.4n/a



LES LABORATOIRES SERVIER; VERNALIS (R&D) LTD

US Patent


Assay Description
The fluorescence polarisation tests were carried out on microplates (384 wells). The Bcl-2 protein, labelled (histag-Bcl-2 such that Bcl-2 correspond...

US Patent US9108983 (2015)


BindingDB Entry DOI: 10.7270/Q2PC314Z
More data for this
Ligand-Target Pair