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BDBM50276494 1-(4-amino-2,6-diisopropylphenyl)-3-((1,4-bis(2-methoxyphenyl)piperidin-4-yl)methyl)urea::CHEMBL501429

SMILES: COc1ccccc1N1CCC(CNC(=O)Nc2c(cc(N)cc2C(C)C)C(C)C)(CC1)c1ccccc1OC

InChI Key: InChIKey=ZXINYPNEKQSLNF-UHFFFAOYSA-N

Data: 1 IC50

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50276494   
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
Sterol O-acyltransferase 1


(Homo sapiens (Human))
BDBM50276494
PNG
(1-(4-amino-2,6-diisopropylphenyl)-3-((1,4-bis(2-me...)
Show SMILES COc1ccccc1N1CCC(CNC(=O)Nc2c(cc(N)cc2C(C)C)C(C)C)(CC1)c1ccccc1OC
Show InChI InChI=1S/C33H44N4O3/c1-22(2)25-19-24(34)20-26(23(3)4)31(25)36-32(38)35-21-33(27-11-7-9-13-29(27)39-5)15-17-37(18-16-33)28-12-8-10-14-30(28)40-6/h7-14,19-20,22-23H,15-18,21,34H2,1-6H3,(H2,35,36,38)
PDB

KEGG

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DrugBank
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 43n/an/an/an/an/an/a



Dainippon Sumitomo Pharma Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of ACAT in human HepG2 cells


Bioorg Med Chem Lett 19: 1062-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.01.020
BindingDB Entry DOI: 10.7270/Q2R78F3M
More data for this
Ligand-Target Pair