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BDBM50130198 CHEMBL3629653

SMILES: [O-][N+](=O)c1cc(ccc1Cl)S(=O)(=O)NC(=O)[C@H](Cc1ccccc1)N1C(=O)N[C@@H](Cc2ccc(Br)cc2)C1=O

InChI Key: InChIKey=SKJJNSZIXFNENI-UNMCSNQZSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50130198   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Apoptosis regulator Bcl-2


(Homo sapiens (Human))
BDBM50130198
PNG
(CHEMBL3629653)
Show SMILES [O-][N+](=O)c1cc(ccc1Cl)S(=O)(=O)NC(=O)[C@H](Cc1ccccc1)N1C(=O)N[C@@H](Cc2ccc(Br)cc2)C1=O
Show InChI InChI=1S/C25H20BrClN4O7S/c26-17-8-6-16(7-9-17)12-20-24(33)30(25(34)28-20)22(13-15-4-2-1-3-5-15)23(32)29-39(37,38)18-10-11-19(27)21(14-18)31(35)36/h1-11,14,20,22H,12-13H2,(H,28,34)(H,29,32)/t20-,22-/m0/s1
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Article
PubMed
>5.00E+4n/an/an/an/an/an/an/an/a



Shandong University

Curated by ChEMBL


Assay Description
Competitive binding affinity to Bcl-2 (unknown origin) preincubated for 30 mins followed by 5-FAM-Bid-BH3 peptide addition measured after 20 mins by ...


Bioorg Med Chem 23: 7359-65 (2015)


Article DOI: 10.1016/j.bmc.2015.10.023
BindingDB Entry DOI: 10.7270/Q2FQ9ZD8
More data for this
Ligand-Target Pair