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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Acyl coenzyme A:cholesterol acyltransferase 1' and Ligand = 'BDBM50037643'   
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
Acyl coenzyme A:cholesterol acyltransferase 1


(Mus musculus)
BDBM50037643
PNG
(3-(2,4-Difluoro-phenyl)-1-[5-(1,4-diphenyl-1H-imid...)
Show SMILES CCCCCCCN(CCCCCSc1nc(cn1-c1ccccc1)-c1ccccc1)C(=O)Nc1ccc(F)cc1F
Show InChI InChI=1S/C34H40F2N4OS/c1-2-3-4-5-13-22-39(33(41)37-31-21-20-28(35)25-30(31)36)23-14-8-15-24-42-34-38-32(27-16-9-6-10-17-27)26-40(34)29-18-11-7-12-19-29/h6-7,9-12,16-21,25-26H,2-5,8,13-15,22-24H2,1H3,(H,37,41)
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Similars

n/an/a 6.02E+3n/an/an/an/an/an/a



The DuPont Merck Pharmaceutical Company

Curated by ChEMBL


Assay Description
Inhibition of acyl coenzyme A:cholesterol acyltransferase (ACAT) in J774 Macrophage cell culture by using J774 assay.


Bioorg Med Chem Lett 5: 167-72 (1995)


BindingDB Entry DOI: 10.7270/Q2Z03833
More data for this
Ligand-Target Pair