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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 = 'BDBM161615'   
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))
BDBM161615
PNG
(US9108983, Example 432)
Show SMILES Cc1c(cnn1C)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n(C)c1C)c1ccc(O)cc1
Show InChI InChI=1S/C39H41ClN6O4/c1-25-34(39(49)46(30-10-12-32(47)13-11-30)37-22-41-43(4)26(37)2)21-36(42(25)3)35-20-29(40)9-14-33(35)38(48)45-23-28-8-6-5-7-27(28)19-31(45)24-44-15-17-50-18-16-44/h5-14,20-22,31,47H,15-19,23-24H2,1-4H3/t31-/m0/s1
PDB

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PC cid
PC sid
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Similars

US Patent
n/an/a 3.40n/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