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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Apolipoprotein B-100' and Ligand = 'BDBM50107779'   
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
Apolipoprotein B-100


(Homo sapiens (Human))
BDBM50107779
PNG
(6-Methyl-4'-trifluoromethyl-biphenyl-2-carboxylic ...)
Show SMILES Cc1cccc(C(=O)Nc2ccc3CC(CNS(C)(=O)=O)Cc3c2)c1-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C26H25F3N2O3S/c1-16-4-3-5-23(24(16)18-6-9-21(10-7-18)26(27,28)29)25(32)31-22-11-8-19-12-17(13-20(19)14-22)15-30-35(2,33)34/h3-11,14,17,30H,12-13,15H2,1-2H3,(H,31,32)
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PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 6.5n/an/an/an/an/an/a



Novartis Institute for Biomedical Reasearch

Curated by ChEMBL


Assay Description
Inhibition of apolipoprotein B (apoB) secreted by human hepatoma cells (Hep G2) at 100 nM


J Med Chem 44: 4677-87 (2001)


BindingDB Entry DOI: 10.7270/Q23F4NXH
More data for this
Ligand-Target Pair