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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 = 'BDBM354653'   
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))
BDBM354653
PNG
(Tolyl 6-[4-[(5-cyano-1,2-dimethyl-1H-pyrrol-3-yl)-...)
Show SMILES Cc1c(cc(C#N)n1C)N(C(=O)c1cc(-c2cc3CCN(Cc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)C(=O)Oc2ccc(C)cc2)n(C)c1C)c1ccc(O)cc1
Show InChI InChI=1S/C52H53N7O6/c1-33-10-16-44(17-11-33)65-52(63)57-19-18-37-25-46(47(26-39(37)30-57)50(61)58-31-38-9-7-6-8-36(38)24-42(58)32-56-20-22-64-23-21-56)49-28-45(34(2)55(49)5)51(62)59(40-12-14-43(60)15-13-40)48-27-41(29-53)54(4)35(48)3/h6-17,25-28,42,60H,18-24,30-32H2,1-5H3/t42-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
Article
US Patent
n/an/a 3.10n/an/an/an/an/an/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 US9809574 (2017)


Article DOI: 10.1021/jm070125f
BindingDB Entry DOI: 10.7270/Q2MP55DF
More data for this
Ligand-Target Pair